CAS 7019-01-4 | 4-(Phenylsulfonyl)aniline | CAS Number 7019-01-4

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7019-01-4 | 4-(Phenylsulfonyl)aniline

CAS No: 7019-01-4 Catalog No: AG0039WS MDL No:MFCD00625703

Product Description

Catalog Number:

AG0039WS

Chemical Name:

4-(Phenylsulfonyl)aniline

CAS Number:

7019-01-4

Molecular Formula:

C12H11NO2S

Molecular Weight:

233.2862

MDL Number:

MFCD00625703

IUPAC Name:

4-(benzenesulfonyl)aniline

InChI:

InChI=1S/C12H11NO2S/c13-10-6-8-12(9-7-10)16(14,15)11-4-2-1-3-5-11/h1-9H,13H2

InChI Key:

GDYFDXDATVPPDR-UHFFFAOYSA-N

SMILES:

Nc1ccc(cc1)S(=O)(=O)c1ccccc1

Properties

Complexity:

306

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.285g/mol

Monoisotopic Mass:

233.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8

Literature

Title	Journal
Folate-synthesizing enzyme system as target for development of inhibitors and inhibitor combinations against Candida albicans-synthesis and biological activity of new 2,4-diaminopyrimidines and 4'-substituted 4-aminodiphenyl sulfones.	Journal of medicinal chemistry 20040101
QSAR analysis of antibacterial activity of some 4-aminodiphenylsulfone derivatives.	Acta microbiologica et immunologica Hungarica 20030101
Non-thiol farnesyltransferase inhibitors: evaluation of different AA(X)-peptidomimetic substructures in combination with arylic cysteine replacements.	Archiv der Pharmazie 20020401