4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide

C20H17ClN2O4S — CID 2982933

IUPAC4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2)cc1Cl
InChIInChI=1S/C20H17ClN2O4S/c1-27-19-12-11-16(13-18(19)21)22-20(24)14-7-9-15(10-8-14)23-28(25,26)17-5-3-2-4-6-17/h2-13,23H,1H3,(H,22,24)
InChIKeyIIJUNCGHFFGQMB-UHFFFAOYSA-N
MW416.89 g/mol
LogP4.40
Rot. Bonds6

About 4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide

4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide (PubChem CID 2982933) has the molecular formula C20H17ClN2O4S and a molecular weight of 416.89 g/mol. Its IUPAC name is 4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide
PubChem CID2982933
Molecular FormulaC20H17ClN2O4S
Molecular Weight416.89 g/mol
Exact Mass416.06
IUPAC Name4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2)cc1Cl
InChIInChI=1S/C20H17ClN2O4S/c1-27-19-12-11-16(13-18(19)21)22-20(24)14-7-9-15(10-8-14)23-28(25,26)17-5-3-2-4-6-17/h2-13,23H,1H3,(H,22,24)
InChIKeyIIJUNCGHFFGQMB-UHFFFAOYSA-N
XLogP4.40
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.89
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetamido-4-methoxyphenyl)-4-(phenylsulfamoyl)benzamide
CID 24666755
4-(benzenesulfonamido)-N-[4-[(3-chloro-4-methylphenyl)sulfamoyl]phenyl]benzamide
CID 126416723
methyl 4-[(3-chloro-4-methoxyphenyl)sulfamoyl]benzoate
CID 26487204
4-(benzenesulfonamido)-N-(3,4-diethoxyphenyl)benzamide
CID 43009389
4-(benzenesulfonamido)-N-[4-[4-[[4-(benzenesulfonamido)benzoyl]amino]-3-methoxyphenyl]-2-methoxyphenyl]benzamide
CID 121043668
4-(benzenesulfonamido)-N-[4-[(2,4-dimethoxyphenyl)sulfamoyl]phenyl]benzamide
CID 126415575
N-(3-chloro-4-methoxyphenyl)-4-(dimethylsulfamoyl)benzamide
CID 2464580
N-(3,4-dimethoxyphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26695232
N-(3-chloro-4-methoxyphenyl)-3-[(5-chloro-2-methoxyphenyl)sulfamoyl]benzamide
CID 27256046
4-(benzenesulfonamido)-N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)benzamide
CID 41018256
ethyl 5-[[4-(benzenesulfonamido)benzoyl]amino]-2-chlorobenzoate
CID 28573562
N-(5-acetamido-2-chlorophenyl)-4-(benzenesulfonamido)benzamide
CID 55981241

Frequently Asked Questions

What is the IUPAC name of 4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide?
The IUPAC name of 4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide (CID 2982933) is 4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide.
What is the SMILES notation for 4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide?
The canonical SMILES for 4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide is COc1ccc(NC(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2)cc1Cl.
What is the InChIKey of 4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide?
The InChIKey is IIJUNCGHFFGQMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O4S/c1-27-19-12-11-16(13-18(19)21)22-20(24)14-7-9-15(10-8-14)23-28(25,26)17-5-3-2-4-6-17/h2-13,23H,1H3,(H,22,24).
What are the key properties of 4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide?
4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide has a molecular weight of 416.89 g/mol, XLogP of 4.40, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzenesulfonamido)-N-(3-chloro-4-methoxyphenyl)benzamide is sourced from PubChem (CID 2982933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).