2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide

C14H11BrClNO2S — CID 66810710

IUPAC2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide
SMILESO=S(=O)(C=Cc1ccc(Br)cc1)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H11BrClNO2S/c15-12-3-1-11(2-4-12)9-10-20(18,19)17-14-7-5-13(16)6-8-14/h1-10,17H
InChIKeyREEQLYAMNBKRPB-UHFFFAOYSA-N
MW372.67 g/mol
LogP4.52
Rot. Bonds4

About 2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide

2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide (PubChem CID 66810710) has the molecular formula C14H11BrClNO2S and a molecular weight of 372.67 g/mol. Its IUPAC name is 2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide.

Molecular Properties

Compound Name2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide
PubChem CID66810710
Molecular FormulaC14H11BrClNO2S
Molecular Weight372.67 g/mol
Exact Mass370.94
IUPAC Name2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide
SMILESO=S(=O)(C=Cc1ccc(Br)cc1)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H11BrClNO2S/c15-12-3-1-11(2-4-12)9-10-20(18,19)17-14-7-5-13(16)6-8-14/h1-10,17H
InChIKeyREEQLYAMNBKRPB-UHFFFAOYSA-N
XLogP4.52
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.67
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide?
The IUPAC name of 2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide (CID 66810710) is 2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide.
What is the SMILES notation for 2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide?
The canonical SMILES for 2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide is O=S(=O)(C=Cc1ccc(Br)cc1)Nc1ccc(Cl)cc1.
What is the InChIKey of 2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide?
The InChIKey is REEQLYAMNBKRPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClNO2S/c15-12-3-1-11(2-4-12)9-10-20(18,19)17-14-7-5-13(16)6-8-14/h1-10,17H.
What are the key properties of 2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide?
2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide has a molecular weight of 372.67 g/mol, XLogP of 4.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-N-(4-chlorophenyl)ethenesulfonamide is sourced from PubChem (CID 66810710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).