2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide

C21H19ClN2O4S — CID 1334368

IUPAC2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide
SMILESCOc1ccc(S(=O)(=O)N(CC(=O)Nc2ccccc2)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C21H19ClN2O4S/c1-28-19-11-13-20(14-12-19)29(26,27)24(18-9-7-16(22)8-10-18)15-21(25)23-17-5-3-2-4-6-17/h2-14H,15H2,1H3,(H,23,25)
InChIKeyOWIFGXKBGAVVKR-UHFFFAOYSA-N
MW430.91 g/mol
LogP4.18
Rot. Bonds7

About 2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide

2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide (PubChem CID 1334368) has the molecular formula C21H19ClN2O4S and a molecular weight of 430.91 g/mol. Its IUPAC name is 2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide.

Molecular Properties

Compound Name2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide
PubChem CID1334368
Molecular FormulaC21H19ClN2O4S
Molecular Weight430.91 g/mol
Exact Mass430.08
IUPAC Name2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide
SMILESCOc1ccc(S(=O)(=O)N(CC(=O)Nc2ccccc2)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C21H19ClN2O4S/c1-28-19-11-13-20(14-12-19)29(26,27)24(18-9-7-16(22)8-10-18)15-21(25)23-17-5-3-2-4-6-17/h2-14H,15H2,1H3,(H,23,25)
InChIKeyOWIFGXKBGAVVKR-UHFFFAOYSA-N
XLogP4.18
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.91
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(N-(4-chlorophenyl)sulfonyl-4-methoxyanilino)-N-phenylacetamide
CID 4882632
N-(4-chlorophenyl)-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide
CID 1099949
2-(4-chloro-N-(4-chlorophenyl)sulfonylanilino)-N-phenylacetamide
CID 1472193
2-[N-(benzenesulfonyl)-4-chloroanilino]-N-phenylacetamide
CID 1475349
2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-(4-ethylphenyl)acetamide
CID 53280578
2-[N-(benzenesulfonyl)-4-ethoxyanilino]-N-(4-chlorophenyl)acetamide
CID 1343150
2-(N-(4-chlorophenyl)sulfonylanilino)-N-(4-ethoxyphenyl)acetamide
CID 1318540
2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-(2-methylsulfanylphenyl)acetamide
CID 1295912
2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-[4-[(4-fluorophenyl)sulfamoyl]phenyl]acetamide
CID 43880636
N-(4-acetamidophenyl)-2-(N-(4-chlorophenyl)sulfonylanilino)acetamide
CID 126153307
N-(3-chlorophenyl)-2-(4-fluoro-N-(4-methoxyphenyl)sulfonylanilino)acetamide
CID 126387654
2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-(2,3-dichlorophenyl)acetamide
CID 21372845

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide?
The IUPAC name of 2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide (CID 1334368) is 2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide.
What is the SMILES notation for 2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide?
The canonical SMILES for 2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide is COc1ccc(S(=O)(=O)N(CC(=O)Nc2ccccc2)c2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide?
The InChIKey is OWIFGXKBGAVVKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN2O4S/c1-28-19-11-13-20(14-12-19)29(26,27)24(18-9-7-16(22)8-10-18)15-21(25)23-17-5-3-2-4-6-17/h2-14H,15H2,1H3,(H,23,25).
What are the key properties of 2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide?
2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide has a molecular weight of 430.91 g/mol, XLogP of 4.18, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide is sourced from PubChem (CID 1334368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).