N-benzhydryl-4-chlorobenzenesulfonamide

C19H16ClNO2S — CID 985375

IUPACN-benzhydryl-4-chlorobenzenesulfonamide
SMILESO=S(=O)(NC(c1ccccc1)c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C19H16ClNO2S/c20-17-11-13-18(14-12-17)24(22,23)21-19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14,19,21H
InChIKeyRWLPLORXXNRBSK-UHFFFAOYSA-N
MW357.86 g/mol
LogP4.41
Rot. Bonds5

About N-benzhydryl-4-chlorobenzenesulfonamide

N-benzhydryl-4-chlorobenzenesulfonamide (PubChem CID 985375) has the molecular formula C19H16ClNO2S and a molecular weight of 357.86 g/mol. Its IUPAC name is N-benzhydryl-4-chlorobenzenesulfonamide.

Molecular Properties

Compound NameN-benzhydryl-4-chlorobenzenesulfonamide
PubChem CID985375
Molecular FormulaC19H16ClNO2S
Molecular Weight357.86 g/mol
Exact Mass357.06
IUPAC NameN-benzhydryl-4-chlorobenzenesulfonamide
SMILESO=S(=O)(NC(c1ccccc1)c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C19H16ClNO2S/c20-17-11-13-18(14-12-17)24(22,23)21-19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14,19,21H
InChIKeyRWLPLORXXNRBSK-UHFFFAOYSA-N
XLogP4.41
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.86
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-4-chlorobenzenesulfonamide?
The IUPAC name of N-benzhydryl-4-chlorobenzenesulfonamide (CID 985375) is N-benzhydryl-4-chlorobenzenesulfonamide.
What is the SMILES notation for N-benzhydryl-4-chlorobenzenesulfonamide?
The canonical SMILES for N-benzhydryl-4-chlorobenzenesulfonamide is O=S(=O)(NC(c1ccccc1)c1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of N-benzhydryl-4-chlorobenzenesulfonamide?
The InChIKey is RWLPLORXXNRBSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClNO2S/c20-17-11-13-18(14-12-17)24(22,23)21-19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14,19,21H.
What are the key properties of N-benzhydryl-4-chlorobenzenesulfonamide?
N-benzhydryl-4-chlorobenzenesulfonamide has a molecular weight of 357.86 g/mol, XLogP of 4.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-4-chlorobenzenesulfonamide is sourced from PubChem (CID 985375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).