2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide

C24H26N2O4S — CID 126154891

IUPAC2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide
SMILESCOc1ccc(S(=O)(=O)N(CC(=O)Nc2ccccc2C(C)C)c2ccccc2)cc1
InChIInChI=1S/C24H26N2O4S/c1-18(2)22-11-7-8-12-23(22)25-24(27)17-26(19-9-5-4-6-10-19)31(28,29)21-15-13-20(30-3)14-16-21/h4-16,18H,17H2,1-3H3,(H,25,27)
InChIKeyYUJDKZZFPLBJRK-UHFFFAOYSA-N
MW438.55 g/mol
LogP4.65
Rot. Bonds8

About 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide

2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide (PubChem CID 126154891) has the molecular formula C24H26N2O4S and a molecular weight of 438.55 g/mol. Its IUPAC name is 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide
PubChem CID126154891
Molecular FormulaC24H26N2O4S
Molecular Weight438.55 g/mol
Exact Mass438.16
IUPAC Name2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide
SMILESCOc1ccc(S(=O)(=O)N(CC(=O)Nc2ccccc2C(C)C)c2ccccc2)cc1
InChIInChI=1S/C24H26N2O4S/c1-18(2)22-11-7-8-12-23(22)25-24(27)17-26(19-9-5-4-6-10-19)31(28,29)21-15-13-20(30-3)14-16-21/h4-16,18H,17H2,1-3H3,(H,25,27)
InChIKeyYUJDKZZFPLBJRK-UHFFFAOYSA-N
XLogP4.65
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.55
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide (CID 126154891) is 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide is COc1ccc(S(=O)(=O)N(CC(=O)Nc2ccccc2C(C)C)c2ccccc2)cc1.
What is the InChIKey of 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is YUJDKZZFPLBJRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O4S/c1-18(2)22-11-7-8-12-23(22)25-24(27)17-26(19-9-5-4-6-10-19)31(28,29)21-15-13-20(30-3)14-16-21/h4-16,18H,17H2,1-3H3,(H,25,27).
What are the key properties of 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide?
2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 438.55 g/mol, XLogP of 4.65, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 126154891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).