4-bromo-N-(2-phenylphenyl)benzenesulfonamide

C18H14BrNO2S — CID 19684169

IUPAC4-bromo-N-(2-phenylphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1-c1ccccc1)c1ccc(Br)cc1
InChIInChI=1S/C18H14BrNO2S/c19-15-10-12-16(13-11-15)23(21,22)20-18-9-5-4-8-17(18)14-6-2-1-3-7-14/h1-13,20H
InChIKeyDIFOPPXPRNCJRV-UHFFFAOYSA-N
MW388.29 g/mol
LogP4.92
Rot. Bonds4

About 4-bromo-N-(2-phenylphenyl)benzenesulfonamide

4-bromo-N-(2-phenylphenyl)benzenesulfonamide (PubChem CID 19684169) has the molecular formula C18H14BrNO2S and a molecular weight of 388.29 g/mol. Its IUPAC name is 4-bromo-N-(2-phenylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-bromo-N-(2-phenylphenyl)benzenesulfonamide
PubChem CID19684169
Molecular FormulaC18H14BrNO2S
Molecular Weight388.29 g/mol
Exact Mass386.99
IUPAC Name4-bromo-N-(2-phenylphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1-c1ccccc1)c1ccc(Br)cc1
InChIInChI=1S/C18H14BrNO2S/c19-15-10-12-16(13-11-15)23(21,22)20-18-9-5-4-8-17(18)14-6-2-1-3-7-14/h1-13,20H
InChIKeyDIFOPPXPRNCJRV-UHFFFAOYSA-N
XLogP4.92
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.29
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-N-[2-(3-methoxyphenyl)phenyl]benzenesulfonamide
CID 135086781
4-bromo-N-[4-[(4-bromophenyl)sulfonylamino]naphthalen-1-yl]benzenesulfonamide
CID 5259114
4-(2,5-dioxopyrrolidin-1-yl)-N-(2-phenylphenyl)benzenesulfonamide
CID 100540065
4-bromo-N-[2-(difluoromethylsulfanyl)phenyl]benzenesulfonamide
CID 26968476
N-[2-[(4-bromophenyl)sulfonylamino]phenyl]acetamide
CID 113093694
3-methyl-N-(2-phenylphenyl)benzenesulfonamide
CID 3384228
N-(5-bromo-2-methylphenyl)-4-phenylbenzenesulfonamide
CID 4677884
4-phenyl-N-(4-phenylthiophen-3-yl)benzenesulfonamide
CID 10237527
4-methyl-N-[2-[2-[(4-methylphenyl)sulfonylamino]phenyl]phenyl]benzenesulfonamide
CID 1010988
4-chloro-N-[2-[2-[(4-chlorophenyl)sulfonylamino]phenyl]phenyl]benzenesulfonamide
CID 3366097
2-[2-[(4-bromophenyl)sulfonylamino]phenyl]-5-hydroxy-6-oxo-1H-pyrimidine-4-carboxylic acid
CID 135434224
4-bromo-N-(2-chloro-3-pyridinyl)benzenesulfonamide
CID 4994113

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(2-phenylphenyl)benzenesulfonamide?
The IUPAC name of 4-bromo-N-(2-phenylphenyl)benzenesulfonamide (CID 19684169) is 4-bromo-N-(2-phenylphenyl)benzenesulfonamide.
What is the SMILES notation for 4-bromo-N-(2-phenylphenyl)benzenesulfonamide?
The canonical SMILES for 4-bromo-N-(2-phenylphenyl)benzenesulfonamide is O=S(=O)(Nc1ccccc1-c1ccccc1)c1ccc(Br)cc1.
What is the InChIKey of 4-bromo-N-(2-phenylphenyl)benzenesulfonamide?
The InChIKey is DIFOPPXPRNCJRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14BrNO2S/c19-15-10-12-16(13-11-15)23(21,22)20-18-9-5-4-8-17(18)14-6-2-1-3-7-14/h1-13,20H.
What are the key properties of 4-bromo-N-(2-phenylphenyl)benzenesulfonamide?
4-bromo-N-(2-phenylphenyl)benzenesulfonamide has a molecular weight of 388.29 g/mol, XLogP of 4.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(2-phenylphenyl)benzenesulfonamide is sourced from PubChem (CID 19684169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).