N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide

C24H26N2O7S — CID 1308258

IUPACN-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide
SMILESCOc1ccc(S(=O)(=O)N(CC(=O)Nc2cc(OC)ccc2OC)c2ccccc2OC)cc1
InChIInChI=1S/C24H26N2O7S/c1-30-17-9-12-19(13-10-17)34(28,29)26(21-7-5-6-8-23(21)33-4)16-24(27)25-20-15-18(31-2)11-14-22(20)32-3/h5-15H,16H2,1-4H3,(H,25,27)
InChIKeyAEAWWAHOTGUQPJ-UHFFFAOYSA-N
MW486.55 g/mol
LogP3.56
Rot. Bonds10

About N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide

N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide (PubChem CID 1308258) has the molecular formula C24H26N2O7S and a molecular weight of 486.55 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide
PubChem CID1308258
Molecular FormulaC24H26N2O7S
Molecular Weight486.55 g/mol
Exact Mass486.15
IUPAC NameN-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide
SMILESCOc1ccc(S(=O)(=O)N(CC(=O)Nc2cc(OC)ccc2OC)c2ccccc2OC)cc1
InChIInChI=1S/C24H26N2O7S/c1-30-17-9-12-19(13-10-17)34(28,29)26(21-7-5-6-8-23(21)33-4)16-24(27)25-20-15-18(31-2)11-14-22(20)32-3/h5-15H,16H2,1-4H3,(H,25,27)
InChIKeyAEAWWAHOTGUQPJ-UHFFFAOYSA-N
XLogP3.56
TPSA103.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500486.55
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide (CID 1308258) is N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide is COc1ccc(S(=O)(=O)N(CC(=O)Nc2cc(OC)ccc2OC)c2ccccc2OC)cc1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide?
The InChIKey is AEAWWAHOTGUQPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O7S/c1-30-17-9-12-19(13-10-17)34(28,29)26(21-7-5-6-8-23(21)33-4)16-24(27)25-20-15-18(31-2)11-14-22(20)32-3/h5-15H,16H2,1-4H3,(H,25,27).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide?
N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide has a molecular weight of 486.55 g/mol, XLogP of 3.56, 10 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide is sourced from PubChem (CID 1308258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).