N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide

C17H17ClN2O5S — CID 35348603

IUPACN-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide
SMILESCOc1ccc(NC(=O)CS(=O)(=O)c2ccc(Cl)cc2)cc1NC(C)=O
InChIInChI=1S/C17H17ClN2O5S/c1-11(21)19-15-9-13(5-8-16(15)25-2)20-17(22)10-26(23,24)14-6-3-12(18)4-7-14/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyVPOKQYPLQMYGTH-UHFFFAOYSA-N
MW396.85 g/mol
LogP2.72
Rot. Bonds6

About N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide

N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide (PubChem CID 35348603) has the molecular formula C17H17ClN2O5S and a molecular weight of 396.85 g/mol. Its IUPAC name is N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide.

Molecular Properties

Compound NameN-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide
PubChem CID35348603
Molecular FormulaC17H17ClN2O5S
Molecular Weight396.85 g/mol
Exact Mass396.05
IUPAC NameN-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide
SMILESCOc1ccc(NC(=O)CS(=O)(=O)c2ccc(Cl)cc2)cc1NC(C)=O
InChIInChI=1S/C17H17ClN2O5S/c1-11(21)19-15-9-13(5-8-16(15)25-2)20-17(22)10-26(23,24)14-6-3-12(18)4-7-14/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyVPOKQYPLQMYGTH-UHFFFAOYSA-N
XLogP2.72
TPSA101.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.85
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide 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-(5-chloro-2-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide
CID 27449091
2-(4-chlorophenyl)sulfonyl-N-(2-methoxy-5-methylphenyl)acetamide
CID 25392753
2-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
CID 27449078
N-(5-acetamido-2-methoxyphenyl)-3-[(4-chlorophenyl)sulfonylamino]propanamide
CID 17481718
3-(4-chlorophenyl)sulfonyl-N-(3,4-dimethoxyphenyl)propanamide
CID 46797612
2-(4-chlorophenyl)sulfonyl-N-[4-fluoro-3-(methanesulfonamido)phenyl]acetamide
CID 24677242
N-(3-acetamido-4-methoxyphenyl)-2-(3-chlorophenyl)acetamide
CID 110778435
2-(4-chlorophenyl)sulfonyl-N-(3,5-dimethylphenyl)acetamide
CID 7544014
N-(3,4-difluorophenyl)-2-(4-methoxyphenyl)sulfonylacetamide
CID 86992863
N-(5-acetamido-2-methoxyphenyl)-2-(4-ethylsulfonylanilino)acetamide
CID 16609082
N-(5-acetamido-2-methoxyphenyl)-2-(4-chlorophenyl)sulfanylacetamide
CID 26552817
N-(5-acetamido-2-methoxyphenyl)-4-(4-chlorophenyl)-4-oxobutanamide
CID 26889665

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide?
The IUPAC name of N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide (CID 35348603) is N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide.
What is the SMILES notation for N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide?
The canonical SMILES for N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide is COc1ccc(NC(=O)CS(=O)(=O)c2ccc(Cl)cc2)cc1NC(C)=O.
What is the InChIKey of N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide?
The InChIKey is VPOKQYPLQMYGTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O5S/c1-11(21)19-15-9-13(5-8-16(15)25-2)20-17(22)10-26(23,24)14-6-3-12(18)4-7-14/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide?
N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide has a molecular weight of 396.85 g/mol, XLogP of 2.72, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfonylacetamide is sourced from PubChem (CID 35348603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).