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

C14H10Cl3NO3S — CID 11245920

IUPAC2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide
SMILESCc1ccc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)cc1Cl
InChIInChI=1S/C14H10Cl3NO3S/c1-8-2-4-10(7-12(8)16)22(20,21)18-14(19)11-5-3-9(15)6-13(11)17/h2-7H,1H3,(H,18,19)
InChIKeyDZNRLDJRJXFYKU-UHFFFAOYSA-N
MW378.66 g/mol
LogP4.07
Rot. Bonds3

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

2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide (PubChem CID 11245920) has the molecular formula C14H10Cl3NO3S and a molecular weight of 378.66 g/mol. Its IUPAC name is 2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide.

Molecular Properties

Compound Name2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide
PubChem CID11245920
Molecular FormulaC14H10Cl3NO3S
Molecular Weight378.66 g/mol
Exact Mass376.94
IUPAC Name2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide
SMILESCc1ccc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)cc1Cl
InChIInChI=1S/C14H10Cl3NO3S/c1-8-2-4-10(7-12(8)16)22(20,21)18-14(19)11-5-3-9(15)6-13(11)17/h2-7H,1H3,(H,18,19)
InChIKeyDZNRLDJRJXFYKU-UHFFFAOYSA-N
XLogP4.07
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.66
LogP ≤ 54.07
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-sulfamoylbenzamide
CID 12698190
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-methylphenyl)sulfonylbenzamide
CID 11393780
N-(4-bromophenyl)sulfonyl-2,4-dichlorobenzamide
CID 11441201
4-chloro-N-(4-chlorophenyl)sulfonyl-2-methylbenzamide
CID 11445097

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide?
The IUPAC name of 2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide (CID 11245920) is 2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide.
What is the SMILES notation for 2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide?
The canonical SMILES for 2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide is Cc1ccc(S(=O)(=O)NC(=O)c2ccc(Cl)cc2Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide?
The InChIKey is DZNRLDJRJXFYKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3NO3S/c1-8-2-4-10(7-12(8)16)22(20,21)18-14(19)11-5-3-9(15)6-13(11)17/h2-7H,1H3,(H,18,19).
What are the key properties of 2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide?
2,4-dichloro-N-(3-chloro-4-methylphenyl)sulfonylbenzamide has a molecular weight of 378.66 g/mol, XLogP of 4.07, 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-chloro-4-methylphenyl)sulfonylbenzamide is sourced from PubChem (CID 11245920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).