(E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide

C15H12BrCl2NO2S — CID 51125459

IUPAC(E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide
SMILESCN(c1ccc(Br)cc1Cl)S(=O)(=O)/C=C/c1ccc(Cl)cc1
InChIInChI=1S/C15H12BrCl2NO2S/c1-19(15-7-4-12(16)10-14(15)18)22(20,21)9-8-11-2-5-13(17)6-3-11/h2-10H,1H3/b9-8+
InChIKeyAEKYEKXWVGBUGH-CMDGGOBGSA-N
MW421.14 g/mol
LogP5.19
Rot. Bonds4

About (E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide

(E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide (PubChem CID 51125459) has the molecular formula C15H12BrCl2NO2S and a molecular weight of 421.14 g/mol. Its IUPAC name is (E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide.

Molecular Properties

Compound Name(E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide
PubChem CID51125459
Molecular FormulaC15H12BrCl2NO2S
Molecular Weight421.14 g/mol
Exact Mass418.91
IUPAC Name(E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide
SMILESCN(c1ccc(Br)cc1Cl)S(=O)(=O)/C=C/c1ccc(Cl)cc1
InChIInChI=1S/C15H12BrCl2NO2S/c1-19(15-7-4-12(16)10-14(15)18)22(20,21)9-8-11-2-5-13(17)6-3-11/h2-10H,1H3/b9-8+
InChIKeyAEKYEKXWVGBUGH-CMDGGOBGSA-N
XLogP5.19
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.14
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-bromo-2-chlorophenyl)-N-ethylmethanesulfonamide
CID 71974147
N-(4-bromo-2-chlorophenyl)-N-[(2-fluorophenyl)methyl]methanesulfonamide
CID 72101812
4-bromo-N-[2-chloro-5-(trifluoromethyl)phenyl]-N-methylbenzenesulfonamide
CID 100469724
N-(4-bromo-2-chlorophenyl)-N-methylbenzenesulfonamide
CID 17942647
N-[(4-bromophenyl)methyl]-N-(2-chlorophenyl)methanesulfonamide
CID 2987747
N-(4-bromophenyl)-2-(4-chlorophenyl)ethene-1-sulfonamide
CID 8190120
N-(4-bromo-2-chlorophenyl)-2-phenylethene-1-sulfonamide
CID 8476457
N-(4-bromo-2-chlorophenyl)-1-phenylmethanesulfonamide
CID 8517196
N-(4-bromophenyl)-N-[(2-chlorophenyl)methyl]methanesulfonamide
CID 11574337
N-(4-bromo-2-chlorophenyl)-2-[(4-chlorophenyl)methylsulfonyl]acetamide
CID 17225284
N-(4-bromo-2-chlorophenyl)-1-(4-chlorophenyl)methanesulfonamide
CID 17312259
N-(4-bromo-2-chlorophenyl)-1-(2-chlorophenyl)methanesulfonamide
CID 17312338

Frequently Asked Questions

What is the IUPAC name of (E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide?
The IUPAC name of (E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide (CID 51125459) is (E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide.
What is the SMILES notation for (E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide?
The canonical SMILES for (E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide is CN(c1ccc(Br)cc1Cl)S(=O)(=O)/C=C/c1ccc(Cl)cc1.
What is the InChIKey of (E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide?
The InChIKey is AEKYEKXWVGBUGH-CMDGGOBGSA-N. The full InChI is InChI=1S/C15H12BrCl2NO2S/c1-19(15-7-4-12(16)10-14(15)18)22(20,21)9-8-11-2-5-13(17)6-3-11/h2-10H,1H3/b9-8+.
What are the key properties of (E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide?
(E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide has a molecular weight of 421.14 g/mol, XLogP of 5.19, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(4-bromo-2-chlorophenyl)-2-(4-chlorophenyl)-N-methylethenesulfonamide is sourced from PubChem (CID 51125459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).