N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide

C19H16ClNO3S — CID 122184513

IUPACN-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2-c2cccc(Cl)c2)cc1
InChIInChI=1S/C19H16ClNO3S/c1-24-16-9-11-17(12-10-16)25(22,23)21-19-8-3-2-7-18(19)14-5-4-6-15(20)13-14/h2-13,21H,1H3
InChIKeyUWPHVKRHIVTPLP-UHFFFAOYSA-N
MW373.86 g/mol
LogP4.82
Rot. Bonds5

About N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide

N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide (PubChem CID 122184513) has the molecular formula C19H16ClNO3S and a molecular weight of 373.86 g/mol. Its IUPAC name is N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide.

Molecular Properties

Compound NameN-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide
PubChem CID122184513
Molecular FormulaC19H16ClNO3S
Molecular Weight373.86 g/mol
Exact Mass373.05
IUPAC NameN-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2-c2cccc(Cl)c2)cc1
InChIInChI=1S/C19H16ClNO3S/c1-24-16-9-11-17(12-10-16)25(22,23)21-19-8-3-2-7-18(19)14-5-4-6-15(20)13-14/h2-13,21H,1H3
InChIKeyUWPHVKRHIVTPLP-UHFFFAOYSA-N
XLogP4.82
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.86
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide?
The IUPAC name of N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide (CID 122184513) is N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide.
What is the SMILES notation for N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide?
The canonical SMILES for N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide is COc1ccc(S(=O)(=O)Nc2ccccc2-c2cccc(Cl)c2)cc1.
What is the InChIKey of N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide?
The InChIKey is UWPHVKRHIVTPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClNO3S/c1-24-16-9-11-17(12-10-16)25(22,23)21-19-8-3-2-7-18(19)14-5-4-6-15(20)13-14/h2-13,21H,1H3.
What are the key properties of N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide?
N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide has a molecular weight of 373.86 g/mol, XLogP of 4.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-chlorophenyl)phenyl]-4-methoxybenzenesulfonamide is sourced from PubChem (CID 122184513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).