N-(4-anilino-3-chlorophenyl)benzenesulfonamide

C18H15ClN2O2S — CID 14669536

IUPACN-(4-anilino-3-chlorophenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(Nc2ccccc2)c(Cl)c1)c1ccccc1
InChIInChI=1S/C18H15ClN2O2S/c19-17-13-15(21-24(22,23)16-9-5-2-6-10-16)11-12-18(17)20-14-7-3-1-4-8-14/h1-13,20-21H
InChIKeyNYZFBDBSVOXYGL-UHFFFAOYSA-N
MW358.85 g/mol
LogP4.88
Rot. Bonds5

About N-(4-anilino-3-chlorophenyl)benzenesulfonamide

N-(4-anilino-3-chlorophenyl)benzenesulfonamide (PubChem CID 14669536) has the molecular formula C18H15ClN2O2S and a molecular weight of 358.85 g/mol. Its IUPAC name is N-(4-anilino-3-chlorophenyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(4-anilino-3-chlorophenyl)benzenesulfonamide
PubChem CID14669536
Molecular FormulaC18H15ClN2O2S
Molecular Weight358.85 g/mol
Exact Mass358.05
IUPAC NameN-(4-anilino-3-chlorophenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(Nc2ccccc2)c(Cl)c1)c1ccccc1
InChIInChI=1S/C18H15ClN2O2S/c19-17-13-15(21-24(22,23)16-9-5-2-6-10-16)11-12-18(17)20-14-7-3-1-4-8-14/h1-13,20-21H
InChIKeyNYZFBDBSVOXYGL-UHFFFAOYSA-N
XLogP4.88
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.85
LogP ≤ 54.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-1-N,4-N-diphenylbenzene-1,4-diamine
CID 158558488
[2-[4-(benzenesulfonamido)-2-chlorophenyl]hydrazinyl]-oxo-phenoxyphosphanium
CID 135839794
4-(benzenesulfonamido)-N-phenylbenzenesulfonamide
CID 1333712
N-[3-(benzenesulfonamido)-5-chloro-4-hydroxyphenyl]benzenesulfonamide
CID 2293499
N-[4-(benzenesulfonamido)-2-chlorophenyl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
CID 22287185
1-[4-[(3,4-dichlorophenyl)sulfamoyl]phenyl]-3-phenylurea
CID 4171462
4-(benzenesulfonamido)-2-chloro-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 99942022
N-[6-(2,4-dichloroanilino)pyridazin-3-yl]benzenesulfonamide
CID 113050807
N-(3-benzylphenyl)benzenesulfonamide
CID 3258853
N-[6-(3,4-dichloroanilino)pyridazin-3-yl]benzenesulfonamide
CID 113050774
N-[3-(chloromethyl)phenyl]benzenesulfonamide
CID 65033363
3-(benzenesulfonamido)-N-(3-chloro-4-methylphenyl)benzamide
CID 9412716

Frequently Asked Questions

What is the IUPAC name of N-(4-anilino-3-chlorophenyl)benzenesulfonamide?
The IUPAC name of N-(4-anilino-3-chlorophenyl)benzenesulfonamide (CID 14669536) is N-(4-anilino-3-chlorophenyl)benzenesulfonamide.
What is the SMILES notation for N-(4-anilino-3-chlorophenyl)benzenesulfonamide?
The canonical SMILES for N-(4-anilino-3-chlorophenyl)benzenesulfonamide is O=S(=O)(Nc1ccc(Nc2ccccc2)c(Cl)c1)c1ccccc1.
What is the InChIKey of N-(4-anilino-3-chlorophenyl)benzenesulfonamide?
The InChIKey is NYZFBDBSVOXYGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O2S/c19-17-13-15(21-24(22,23)16-9-5-2-6-10-16)11-12-18(17)20-14-7-3-1-4-8-14/h1-13,20-21H.
What are the key properties of N-(4-anilino-3-chlorophenyl)benzenesulfonamide?
N-(4-anilino-3-chlorophenyl)benzenesulfonamide has a molecular weight of 358.85 g/mol, XLogP of 4.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-anilino-3-chlorophenyl)benzenesulfonamide is sourced from PubChem (CID 14669536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).