2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide

C14H12Cl2N2O3S — CID 92685896

IUPAC2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide
SMILESCS(=O)(=O)Nc1ccc(Cl)c(C(=O)Nc2ccc(Cl)cc2)c1
InChIInChI=1S/C14H12Cl2N2O3S/c1-22(20,21)18-11-6-7-13(16)12(8-11)14(19)17-10-4-2-9(15)3-5-10/h2-8,18H,1H3,(H,17,19)
InChIKeyIXFBOKJDILPBEU-UHFFFAOYSA-N
MW359.23 g/mol
LogP3.62
Rot. Bonds4

About 2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide

2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide (PubChem CID 92685896) has the molecular formula C14H12Cl2N2O3S and a molecular weight of 359.23 g/mol. Its IUPAC name is 2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide.

Molecular Properties

Compound Name2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide
PubChem CID92685896
Molecular FormulaC14H12Cl2N2O3S
Molecular Weight359.23 g/mol
Exact Mass357.99
IUPAC Name2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide
SMILESCS(=O)(=O)Nc1ccc(Cl)c(C(=O)Nc2ccc(Cl)cc2)c1
InChIInChI=1S/C14H12Cl2N2O3S/c1-22(20,21)18-11-6-7-13(16)12(8-11)14(19)17-10-4-2-9(15)3-5-10/h2-8,18H,1H3,(H,17,19)
InChIKeyIXFBOKJDILPBEU-UHFFFAOYSA-N
XLogP3.62
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.23
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-chloro-5-(methanesulfonamido)benzamide
CID 30397176
2-chloro-N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-5-(methanesulfonamido)benzamide
CID 99959560
2-chloro-5-(methanesulfonamido)-N-(4-prop-2-enoxyphenyl)benzamide
CID 46764359
2-chloro-5-(methanesulfonamido)-N-[(2R)-3-methylbutan-2-yl]benzamide
CID 100568601
2-chloro-N-(4-chlorophenyl)-5-methylbenzamide
CID 122630204
2-chloro-5-(methanesulfonamido)-N-[(2R)-pentan-2-yl]benzamide
CID 30397362
methyl 2-[[2-chloro-5-(methanesulfonamido)benzoyl]amino]benzoate
CID 38015776
2-chloro-N-(4-chloro-2-methylphenyl)-4-(methanesulfonamido)benzamide
CID 28580400
2-chloro-N-(2-ethyl-6-methylphenyl)-5-(methanesulfonamido)benzamide
CID 46770786
5-chloro-2-fluoro-N-[4-fluoro-3-(methanesulfonamido)phenyl]benzamide
CID 25487071
N-[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]-2-chloro-5-(methanesulfonamido)benzamide
CID 92675184
N-(3-acetamidophenyl)-2-chloro-4-(methanesulfonamido)benzamide
CID 28635588

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide?
The IUPAC name of 2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide (CID 92685896) is 2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide.
What is the SMILES notation for 2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide?
The canonical SMILES for 2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide is CS(=O)(=O)Nc1ccc(Cl)c(C(=O)Nc2ccc(Cl)cc2)c1.
What is the InChIKey of 2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide?
The InChIKey is IXFBOKJDILPBEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O3S/c1-22(20,21)18-11-6-7-13(16)12(8-11)14(19)17-10-4-2-9(15)3-5-10/h2-8,18H,1H3,(H,17,19).
What are the key properties of 2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide?
2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide has a molecular weight of 359.23 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide is sourced from PubChem (CID 92685896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).