2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide

C14H11Cl2NO3S — CID 11393780

IUPAC2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide
SMILESCc1cccc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C14H11Cl2NO3S/c1-9-3-2-4-11(7-9)21(19,20)17-14(18)12-6-5-10(15)8-13(12)16/h2-8H,1H3,(H,17,18)
InChIKeyWCFROKQUHQFBGC-UHFFFAOYSA-N
MW344.22 g/mol
LogP3.42
Rot. Bonds3

About 2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide

2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide (PubChem CID 11393780) has the molecular formula C14H11Cl2NO3S and a molecular weight of 344.22 g/mol. Its IUPAC name is 2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide.

Molecular Properties

Compound Name2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide
PubChem CID11393780
Molecular FormulaC14H11Cl2NO3S
Molecular Weight344.22 g/mol
Exact Mass342.98
IUPAC Name2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide
SMILESCc1cccc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C14H11Cl2NO3S/c1-9-3-2-4-11(7-9)21(19,20)17-14(18)12-6-5-10(15)8-13(12)16/h2-8H,1H3,(H,17,18)
InChIKeyWCFROKQUHQFBGC-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
2,4-Dichloro-5-sulfamoyl-benzamide
CID 12698190
N-benzyl-2,4-dichloro-5-sulfamoylbenzamide
CID 126507182
4-Chloro-3-sulfamoyl-benzenecarboxamide
CID 213020
4-Chloro-N-(4-chlorobenzenesulfonyl)benzamide
CID 837182
LY-33169
CID 10021712
2,4-dichloro-N-(3-chloro-4-fluorophenyl)sulfonylbenzamide
CID 11176518
2,4-dichloro-N-(3,4-dichlorophenyl)sulfonylbenzamide
CID 11188738
N-(3-bromophenyl)sulfonyl-2,4-dichlorobenzamide
CID 11200665
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

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide?
The IUPAC name of 2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide (CID 11393780) is 2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide.
What is the SMILES notation for 2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide?
The canonical SMILES for 2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide is Cc1cccc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide?
The InChIKey is WCFROKQUHQFBGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2NO3S/c1-9-3-2-4-11(7-9)21(19,20)17-14(18)12-6-5-10(15)8-13(12)16/h2-8H,1H3,(H,17,18).
What are the key properties of 2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide?
2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide 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 2,4-dichloro-N-(3-methylphenyl)sulfonylbenzamide is sourced from PubChem (CID 11393780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).