Browse
Submit Data
Databases
API
Help

Dataset Information

17 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

N-(4-Hydroxy-phen-yl)benzene-sulfon-amide.

ABSTRACT: The title compound, C(12)H(11)NO(3)S, synthesized by the reaction of benzene sulfonyl chloride with para-amino-phenol, is of inter-est as a precursor to biologically active sulfur-containing heterocyclic compounds. The structure is stabilized by N-H?O and O-H?O hydrogen bonds.

SUBMITTER: Khan IU

PROVIDER: S-EPMC2979209 | biostudies-literature | 2010 Apr

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

N-(4-Hydroxy-phen-yl)benzene-sulfon-amide.

Khan Islam Ullah IU Mariam Irfana I Zia-Ur-Rehman Muhammad M Arif Sajjad Muhammad M Sharif Shahzad S

Acta crystallographica. Section E, Structure reports online 20100414 Pt 5

The title compound, C(12)H(11)NO(3)S, synthesized by the reaction of benzene sulfonyl chloride with para-amino-phenol, is of inter-est as a precursor to biologically active sulfur-containing heterocyclic compounds. The structure is stabilized by N-H⋯O and O-H⋯O hydrogen bonds. ...[more]

PMID: 21579141

Similar Datasets

N-(2-Formyl-phen-yl)-4-methyl-N-[(4-methyl-phen-yl)sulfon-yl]benzene-sulfon-amide.

Project description:In the title compound, C21H19NO5S2, the dihedral angles between the formyl-phenyl ring and the two methyl-phenyl rings are 29.3?(3) and 28.9?(3)°, respectively; the dihedral angle between the methyl-phenyl rings is 48.4?(2)°. The C-N-S-C torsion angles are -74.1?(2) and -105.4?(2)°. In the crystal, molecules are linked by pairs of C-H?O hydrogen bonds, forming inversion dimers.

| S-EPMC4051026 | biostudies-literature

N-(4-Meth-oxy-benzo-yl)benzene-sulfon-amide.

Project description:In the title compound, C14H13NO4S, the dihedral angle between the aromatic rings is 69.81?(1)°; the dihedral angle between the planes defined by the S-N-C=O segment of the central chain and the sulfonyl benzene ring is 74.91?(1)°. In the crystal, the mol-ecules are linked by weak N-H?O hydrogen bonds into C(4) chains running along [100]. The mol-ecules in adjacent chains are linked by weak C-H?O inter-actions, generating R 2 (2) (16) dimeric pairs. Weak C-H?? inter-actions connect the double chains into (001) sheets.

| S-EPMC3998342 | biostudies-literature

N-(2,3-Dimethyl-phen-yl)-4-fluoro-N-[(4-fluoro-phen-yl)sulfon-yl]benzene-sulfonamide.

Project description:In the title compound, C(20)H(17)F(2)NO(4)S(2), the dihedral angles between the o-xylene ring and the fluoro-benzene rings are 31.7?(1) and 32.8?(1)°, and the dihedral angle between the fluoro-benzene rings is 50.9?(1)°. The C-N-S-C torsion angles are 76.7?(2) and 101.8?(2)°. In the crystal, mol-ecules are connected by C-H?O inter-actions into sheets in the ab plane.

| S-EPMC3470340 | biostudies-literature

N-{[4-(4-Meth-oxy-benzene-sulfonamido)-phen-yl]sulfon-yl}acetamide.

Project description:In the title compound, C(15)H(16)N(2)O(6)S(2), the dihedral angle between the benzene rings is 83.2 (3)°. The mol-ecular conformation is stabilized by an intra-molecular C-H⋯O inter-action. In the crystal structure, mol-ecules are linked by N-H⋯O and C-H⋯O hydrogen bonds and additional stabilization is provided by weak C-H⋯π inter-actions.

| S-EPMC3006991 | biostudies-literature

2-Methyl-3-[(4-methyl-phen-yl)sulfon-yl-oxy]-2-{[(4-methyl-phen-yl)sulfon-yloxy]meth-yl}propyl 4-methyl-benzene-sulfonate.

Project description:The title mol-ecule, C(26)H(30)O(9)S(3), adopts an extended conformation whereby two approximately parallel benzene rings [dihedral angle = 8.32?(10)°] are orientated in opposite directions along the pseudo-threefold axis through the central quaternary C atom, while a third ring occupies a position mid-way and face-on to these rings [dihedral angles = 82.28?(10) and 78.81?(7)°]. The crystal packing is dominated by C-H?O contacts and ?-? inter-actions [ring centroid distance = 3.6902?(12)?Å].

| S-EPMC3152050 | biostudies-literature

N-(2-Iodo-phen-yl)benzene-carbox-imid-amide.

Project description:The title compound, C(13)H(11)IN(2), crystallizes with two independent molecules (A and B) in the asymmetric unit. The two aromatic rings are inclined to one another by 73.3?(2)° in molecule A, and by 74.4?(1)° in molecule B. In molecule A, the iodophenyl and the phenyl rings are inlclined to the N=C-N plane by 88.0?(4) and 19.0?(4)°, respectively. In molecule B the corresponding angles are 85.0?(4) and 20.7?(4)°, respectively. In the crystal, the two molecules are not parallel but have a dihedral angle between the iodophenyl rings of 8.6?(1)°, and 44.5?(2)° between the phenyl rings. The A and B molecules are linked vvia N-H?N hydrogen bonds to form -A-B-A-B- chains propagating along direction [100].

| S-EPMC3295497 | biostudies-literature

1,3-Bis{[(4-methyl-phen-yl)sulfon-yl]-oxy}propan-2-yl 4-methyl-benzene-sulfonate.

Project description:In the title sulfonate derivative, C(24)H(26)O(9)S(3), all atoms apart from those of one of the 4-methyl-benzene-sulfonate residues lie approximately in a disc; the dihedral angles between the approximately orthogonal benzene ring and those in the plane are 74.53 (9) and 67.79 (11)°. In the crystal, mol-ecules are consolidated into the three-dimensional architecture by C-H⋯O inter-actions. One of the 4-methyl-benzene-sulfonate residues is disordered over two almost parallel positions; the major component refined to a site-occupancy factor of 0.918 (2).

| S-EPMC3297952 | biostudies-literature

5-Methyl-1-[(4-methyl-phen-yl)sulfon-yl]-1H-pyrazol-3-yl 4-methyl-benzene-sulfonate.

Project description:In the title compound, C(18)H(18)N(2)O(5)S(2), the tolyl rings are oriented at a dihedral angle of 16.15?(11)° with respect to one another. The 5-methyl-1H-pyrazol-3-ol ring is roughly planar (r.m.s. deviation = 0.0231?Å) and subtends angles of 73.82?(8) and 89.85?(8)° with the tolyl rings. In the crystal, very weak ?-? inter-actions between tolyl groups, with centroid-centroid distances of 4.1364?(19) and 4.0630?(16)?Å, together with a C-H?? contact generate a three-dimensional network.

| S-EPMC3393995 | biostudies-literature

4-[(3-Formyl-4-hydroxy-phen-yl)diazen-yl]-N-(pyrimidin-2-yl)benzene-sulfonamide.

Project description:The title mol-ecule, C(17)H(13)N(5)O(4)S, has a trans configuration with respect to the diazenyl (azo) group. The pyrimidine ring and the terminal benzene ring are inclined at angles of 89.38?(4) and 1.6?(6)°, respectively, with respect to the central benzene ring. The conformation of the mol-ecule is in part stabilized by an intra-molecular O-H?O hydrogen bond. In the crystal structure, mol-ecules related through inversion centers form hydrogen-bonded dimers involving the sulfon-amide N-H group and the N atom of the pyrimidine ring.

| S-EPMC2960714 | biostudies-literature

Crystal structure of [2-(tri-ethyl-ammonio)-eth-yl][(2,4,6-triiso-propyl-phen-yl)sulfon-yl]amide tetra-hydrate.

Project description:The zwitterionic title compound, C23H42N2O2S·4H2O, crystallized as a tetrahydrate from a solution of N-[(2,4,6-triiso-propyl-phen-yl)sulfon-yl]aziridine in tri-ethyl-amine, diethyl ether and pentane in the presence of moist air. It is formed by a nucleophillic ring-opening that is assumed to be reversible. The mol-ecular structure shows a major disorder of the triiso-propyl-phenyl group over two equally occupied locations. An inter-esting feature is the uncommon hydrate structure, exhibiting a tape-like motif which can be classified as a transition of the one-dimensional T4(2)6(2) motif into the two-dimensional L4(6)5(7)6(8) motif.

| S-EPMC4420053 | biostudies-literature

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

OmicsDI Databases

PRIDE
PeptideAtlas
MassIVE
JPOST Repository
Physiome Model Repository

EGA
EVA
ENA
LINCS
PAXDB
Cell Collective

MetaboLights
Metabolomics Workbench
MetabolomeExpress
GNPS
BioModels
FAIRDOMHub

ArrayExpress
dbGaP
ExpressionAtlas
GEO
NODE

Information

Databases
Help
API
Contact us
Code on GitHub
Terms of use
Submit Data