2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide

C15H14BrClN2O3S — CID 22300056

IUPAC2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide
SMILESO=C(CNS(=O)(=O)Cc1ccc(Br)cc1)Nc1cccc(Cl)c1
InChIInChI=1S/C15H14BrClN2O3S/c16-12-6-4-11(5-7-12)10-23(21,22)18-9-15(20)19-14-3-1-2-13(17)8-14/h1-8,18H,9-10H2,(H,19,20)
InChIKeyHSCHZUZBAJDAKQ-UHFFFAOYSA-N
MW417.71 g/mol
LogP3.16
Rot. Bonds6

About 2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide

2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide (PubChem CID 22300056) has the molecular formula C15H14BrClN2O3S and a molecular weight of 417.71 g/mol. Its IUPAC name is 2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide
PubChem CID22300056
Molecular FormulaC15H14BrClN2O3S
Molecular Weight417.71 g/mol
Exact Mass415.96
IUPAC Name2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide
SMILESO=C(CNS(=O)(=O)Cc1ccc(Br)cc1)Nc1cccc(Cl)c1
InChIInChI=1S/C15H14BrClN2O3S/c16-12-6-4-11(5-7-12)10-23(21,22)18-9-15(20)19-14-3-1-2-13(17)8-14/h1-8,18H,9-10H2,(H,19,20)
InChIKeyHSCHZUZBAJDAKQ-UHFFFAOYSA-N
XLogP3.16
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.71
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(4-bromophenyl)methylsulfonylamino]-N-(3-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

2-[(4-bromophenyl)methylsulfonylamino]-N-(3,5-dimethylphenyl)acetamide
CID 22300057
2-[(4-chlorophenyl)methylsulfonylamino]-N-phenylacetamide
CID 51711268
N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide
CID 112997895
2-[(4-bromophenyl)methylsulfonylamino]-N-(4-ethoxyphenyl)acetamide
CID 22299884
2-[(4-chlorophenyl)methylsulfonylamino]-N-(4-iodophenyl)acetamide
CID 22300462
4-(4-bromophenoxy)-N-(3-chlorophenyl)butanamide
CID 7900115
2-(3-bromo-5-methylanilino)-N-(3-chlorophenyl)acetamide
CID 107583061
N-(4-bromophenyl)-3-(3-chlorophenyl)propanamide
CID 1407353
(4-bromophenyl)methyl 2-(3-chloroanilino)acetate
CID 82824756
N-(3-chlorophenyl)-2-[(5-methylthiophen-2-yl)sulfonylamino]acetamide
CID 112997887
N-(3-chlorophenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]acetamide
CID 9042351
2-(4-bromo-3-chloroanilino)-N-(3-chlorophenyl)acetamide
CID 107619813

Frequently Asked Questions

What is the IUPAC name of 2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide?
The IUPAC name of 2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide (CID 22300056) is 2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide.
What is the SMILES notation for 2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide?
The canonical SMILES for 2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide is O=C(CNS(=O)(=O)Cc1ccc(Br)cc1)Nc1cccc(Cl)c1.
What is the InChIKey of 2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide?
The InChIKey is HSCHZUZBAJDAKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrClN2O3S/c16-12-6-4-11(5-7-12)10-23(21,22)18-9-15(20)19-14-3-1-2-13(17)8-14/h1-8,18H,9-10H2,(H,19,20).
What are the key properties of 2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide?
2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide has a molecular weight of 417.71 g/mol, XLogP of 3.16, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide is sourced from PubChem (CID 22300056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).