2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide

C14H12BrClFNO2S — CID 69260977

IUPAC2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide
SMILESO=S(=O)(CCc1cc(Cl)ccc1Br)Nc1ccccc1F
InChIInChI=1S/C14H12BrClFNO2S/c15-12-6-5-11(16)9-10(12)7-8-21(19,20)18-14-4-2-1-3-13(14)17/h1-6,9,18H,7-8H2
InChIKeyNDPGBKXMOXSJPV-UHFFFAOYSA-N
MW392.68 g/mol
LogP4.23
Rot. Bonds5

About 2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide

2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide (PubChem CID 69260977) has the molecular formula C14H12BrClFNO2S and a molecular weight of 392.68 g/mol. Its IUPAC name is 2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide.

Molecular Properties

Compound Name2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide
PubChem CID69260977
Molecular FormulaC14H12BrClFNO2S
Molecular Weight392.68 g/mol
Exact Mass390.94
IUPAC Name2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide
SMILESO=S(=O)(CCc1cc(Cl)ccc1Br)Nc1ccccc1F
InChIInChI=1S/C14H12BrClFNO2S/c15-12-6-5-11(16)9-10(12)7-8-21(19,20)18-14-4-2-1-3-13(14)17/h1-6,9,18H,7-8H2
InChIKeyNDPGBKXMOXSJPV-UHFFFAOYSA-N
XLogP4.23
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.68
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-4-chlorophenyl)-2-phenylethanesulfonamide
CID 80970637
N-(2-fluorophenyl)propane-1-sulfonamide
CID 60640812
2-amino-N-(4-chloro-2-fluorophenyl)ethanesulfonamide
CID 61472414
N-(4-chloro-2-fluorophenyl)propane-1-sulfonamide
CID 60640735
5-chloro-2-fluoro-N-(2-fluorophenyl)benzenesulfonamide
CID 110759379
4-chloro-N-(5-chloro-2-fluorophenyl)butane-1-sulfonamide
CID 116815061
N-(5-bromo-2-fluorophenyl)-2-chloroethanesulfonamide
CID 107650897
N-[2-(2-bromo-5-chlorophenyl)ethyl]methanesulfonamide
CID 122140732
3-amino-N-(2-bromo-4-chlorophenyl)propane-1-sulfonamide
CID 81263929
N-(2-fluorophenyl)-1-phenylmethanesulfonamide
CID 669256
N-(4-chloro-2-methylphenyl)-2-(2-nitrophenyl)ethanesulfonamide
CID 71847210
2-(5-chloro-2-fluorophenyl)ethanesulfonyl chloride
CID 82482802

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide?
The IUPAC name of 2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide (CID 69260977) is 2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide.
What is the SMILES notation for 2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide?
The canonical SMILES for 2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide is O=S(=O)(CCc1cc(Cl)ccc1Br)Nc1ccccc1F.
What is the InChIKey of 2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide?
The InChIKey is NDPGBKXMOXSJPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrClFNO2S/c15-12-6-5-11(16)9-10(12)7-8-21(19,20)18-14-4-2-1-3-13(14)17/h1-6,9,18H,7-8H2.
What are the key properties of 2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide?
2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide has a molecular weight of 392.68 g/mol, XLogP of 4.23, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-5-chlorophenyl)-N-(2-fluorophenyl)ethanesulfonamide is sourced from PubChem (CID 69260977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).