4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide

C14H11Cl2NO3S — CID 11445097

IUPAC4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide
SMILESCc1cc(Cl)ccc1C(=O)NS(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C14H11Cl2NO3S/c1-9-8-11(16)4-7-13(9)14(18)17-21(19,20)12-5-2-10(15)3-6-12/h2-8H,1H3,(H,17,18)
InChIKeySNEWXKIDJFOZMO-UHFFFAOYSA-N
MW344.22 g/mol
LogP3.42
Rot. Bonds3

About 4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide

4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide (PubChem CID 11445097) has the molecular formula C14H11Cl2NO3S and a molecular weight of 344.22 g/mol. Its IUPAC name is 4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide.

Molecular Properties

Compound Name4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide
PubChem CID11445097
Molecular FormulaC14H11Cl2NO3S
Molecular Weight344.22 g/mol
Exact Mass342.98
IUPAC Name4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide
SMILESCc1cc(Cl)ccc1C(=O)NS(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C14H11Cl2NO3S/c1-9-8-11(16)4-7-13(9)14(18)17-21(19,20)12-5-2-10(15)3-6-12/h2-8H,1H3,(H,17,18)
InChIKeySNEWXKIDJFOZMO-UHFFFAOYSA-N
XLogP3.42
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.22
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2,4-dichlorobenzoyl]phenylsulfonamide
CID 9968373
2-Methyl-N-tosylbenzamide
CID 972691
4-Chloro-N-(4-chlorobenzenesulfonyl)benzamide
CID 837182
LY-33169
CID 10021712
4-bromo-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide
CID 11193260
2,4-dichloro-N-(4-methylphenyl)sulfonylbenzamide
CID 11244838
2,4-dichloro-N-(3-chlorophenyl)sulfonylbenzamide
CID 11245472
2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide
CID 11245920
2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide
CID 11393780
N-(4-tert-butylphenyl)sulfonyl-2,4-dichlorobenzamide
CID 11451977
2,4-dichloro-N-(4-fluorophenyl)sulfonylbenzamide
CID 11473497
2,4-dichloro-N-(3-phenylphenyl)sulfonylbenzamide
CID 11750102

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide?
The IUPAC name of 4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide (CID 11445097) is 4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide.
What is the SMILES notation for 4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide?
The canonical SMILES for 4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide is Cc1cc(Cl)ccc1C(=O)NS(=O)(=O)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide?
The InChIKey is SNEWXKIDJFOZMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2NO3S/c1-9-8-11(16)4-7-13(9)14(18)17-21(19,20)12-5-2-10(15)3-6-12/h2-8H,1H3,(H,17,18).
What are the key properties of 4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide?
4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide has a molecular weight of 344.22 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide is sourced from PubChem (CID 11445097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).