N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide

C14H11BrClNO3S — CID 56659875

IUPACN-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NS(=O)(=O)c1ccc(Br)cc1
InChIInChI=1S/C14H11BrClNO3S/c15-11-3-7-13(8-4-11)21(19,20)17-14(18)9-10-1-5-12(16)6-2-10/h1-8H,9H2,(H,17,18)
InChIKeyVAJPYTMPGMTMKB-UHFFFAOYSA-N
MW388.67 g/mol
LogP3.15
Rot. Bonds4

About N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide

N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide (PubChem CID 56659875) has the molecular formula C14H11BrClNO3S and a molecular weight of 388.67 g/mol. Its IUPAC name is N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide
PubChem CID56659875
Molecular FormulaC14H11BrClNO3S
Molecular Weight388.67 g/mol
Exact Mass386.93
IUPAC NameN-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NS(=O)(=O)c1ccc(Br)cc1
InChIInChI=1S/C14H11BrClNO3S/c15-11-3-7-13(8-4-11)21(19,20)17-14(18)9-10-1-5-12(16)6-2-10/h1-8H,9H2,(H,17,18)
InChIKeyVAJPYTMPGMTMKB-UHFFFAOYSA-N
XLogP3.15
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.67
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide 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-chlorophenyl)sulfonyl-2-(4-fluorophenyl)acetamide
CID 56673721
N-(benzenesulfonyl)-2-(4-bromophenyl)acetamide
CID 47108713
N-(4-chlorophenyl)sulfonyl-2-(4-ethoxyphenyl)acetamide
CID 166208857
N-(3-bromo-4-methoxyphenyl)sulfonyl-2-(4-chlorophenyl)acetamide
CID 166199698
2-amino-N-(4-chlorophenyl)sulfonylacetamide
CID 23501070
2-(4-fluorophenyl)-N-(4-fluorophenyl)sulfonylacetamide
CID 56683687
2-(4-bromophenyl)-N-(5-chlorothiophen-2-yl)sulfonylacetamide
CID 47108955
N-(5-bromo-2-ethoxyphenyl)sulfonyl-2-(4-chlorophenyl)acetamide
CID 166189927
2-(4-bromophenyl)-N-(3,4-diethoxyphenyl)sulfonylacetamide
CID 166182044
N-(4-bromophenyl)sulfonyl-3-methylbutanamide
CID 47108774
N-(4-bromophenyl)sulfonyl-2-cyanoacetamide
CID 3848707
2-(4-bromophenyl)-N-thiophen-2-ylsulfonylacetamide
CID 47268843

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide?
The IUPAC name of N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide (CID 56659875) is N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide.
What is the SMILES notation for N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide?
The canonical SMILES for N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide is O=C(Cc1ccc(Cl)cc1)NS(=O)(=O)c1ccc(Br)cc1.
What is the InChIKey of N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide?
The InChIKey is VAJPYTMPGMTMKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClNO3S/c15-11-3-7-13(8-4-11)21(19,20)17-14(18)9-10-1-5-12(16)6-2-10/h1-8H,9H2,(H,17,18).
What are the key properties of N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide?
N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide has a molecular weight of 388.67 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)sulfonyl-2-(4-chlorophenyl)acetamide is sourced from PubChem (CID 56659875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).