4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide

C18H14ClNO2S — CID 10545354

IUPAC4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2ccccc2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C18H14ClNO2S/c19-15-9-5-13(6-10-15)17-3-1-2-4-18(17)14-7-11-16(12-8-14)23(20,21)22/h1-12H,(H2,20,21,22)
InChIKeyLKDQUKKEOTYRQL-UHFFFAOYSA-N
MW343.84 g/mol
LogP4.32
Rot. Bonds3

About 4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide

4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide (PubChem CID 10545354) has the molecular formula C18H14ClNO2S and a molecular weight of 343.84 g/mol. Its IUPAC name is 4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide
PubChem CID10545354
Molecular FormulaC18H14ClNO2S
Molecular Weight343.84 g/mol
Exact Mass343.04
IUPAC Name4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(-c2ccccc2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C18H14ClNO2S/c19-15-9-5-13(6-10-15)17-3-1-2-4-18(17)14-7-11-16(12-8-14)23(20,21)22/h1-12H,(H2,20,21,22)
InChIKeyLKDQUKKEOTYRQL-UHFFFAOYSA-N
XLogP4.32
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.84
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[6-(4-Chloro-phenyl)-spiro[2.4]hept-5-en-5-yl]-benzenesulfonamide
CID 10760960
4-[2-(3-Chloro-4-fluorophenyl)cyclopenten-1-yl]benzenesulfonamide
CID 9906472
4-[2-(4-Chloro-phenyl)-cyclopent-1-enyl]-benzenesulfonamide
CID 10268555
1-(4-Chlorophenyl)-2-[4-(methylsulfonyl)phenyl]benzene
CID 10641092
4-[2-(4-Fluorophenyl)phenyl]benzenesulfonamide
CID 10782440
4-[2-(3-Chloro-4-fluorophenyl)-4,5-difluorophenyl]benzenesulfonamide
CID 10046378
4-[2-(3,4-Dichlorophenyl)cyclopenten-1-yl]benzenesulfonamide
CID 10523033
4-[2-(3-Chloro-4-methylphenyl)-4,5-difluorophenyl]benzenesulfonamide
CID 10644309
3-Chloro-4-fluoro-[1,1'';2'',1'''']terphenyl-4''''-sulfonic acid amide
CID 10784838
4-[2-(4-Chloro-3-methylphenyl)-4,5-difluorophenyl]benzenesulfonamide
CID 10810604
1-chloro-4-{(E)-2-[4-(methylsulfonyl)phenyl]-2-phenylvinyl}benzene
CID 44388916
4-[2-(3-Chloro-4-methylphenyl)-3,4-difluorophenyl]benzenesulfonamide
CID 44394101

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide?
The IUPAC name of 4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide (CID 10545354) is 4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide.
What is the SMILES notation for 4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide?
The canonical SMILES for 4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide is NS(=O)(=O)c1ccc(-c2ccccc2-c2ccc(Cl)cc2)cc1.
What is the InChIKey of 4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide?
The InChIKey is LKDQUKKEOTYRQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClNO2S/c19-15-9-5-13(6-10-15)17-3-1-2-4-18(17)14-7-11-16(12-8-14)23(20,21)22/h1-12H,(H2,20,21,22).
What are the key properties of 4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide?
4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide has a molecular weight of 343.84 g/mol, XLogP of 4.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-chlorophenyl)phenyl]benzenesulfonamide is sourced from PubChem (CID 10545354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).