3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide

C23H24N2O5S — CID 17489130

IUPAC3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide
SMILESCCc1ccc(NS(=O)(=O)c2cc(C(=O)Nc3cccc(OC)c3)ccc2OC)cc1
InChIInChI=1S/C23H24N2O5S/c1-4-16-8-11-18(12-9-16)25-31(27,28)22-14-17(10-13-21(22)30-3)23(26)24-19-6-5-7-20(15-19)29-2/h5-15,25H,4H2,1-3H3,(H,24,26)
InChIKeyZQEWUHVXAIPWJP-UHFFFAOYSA-N
MW440.52 g/mol
LogP4.32
Rot. Bonds8

About 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide

3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide (PubChem CID 17489130) has the molecular formula C23H24N2O5S and a molecular weight of 440.52 g/mol. Its IUPAC name is 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide.

Molecular Properties

Compound Name3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide
PubChem CID17489130
Molecular FormulaC23H24N2O5S
Molecular Weight440.52 g/mol
Exact Mass440.14
IUPAC Name3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide
SMILESCCc1ccc(NS(=O)(=O)c2cc(C(=O)Nc3cccc(OC)c3)ccc2OC)cc1
InChIInChI=1S/C23H24N2O5S/c1-4-16-8-11-18(12-9-16)25-31(27,28)22-14-17(10-13-21(22)30-3)23(26)24-19-6-5-7-20(15-19)29-2/h5-15,25H,4H2,1-3H3,(H,24,26)
InChIKeyZQEWUHVXAIPWJP-UHFFFAOYSA-N
XLogP4.32
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.52
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide?
The IUPAC name of 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide (CID 17489130) is 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide.
What is the SMILES notation for 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide?
The canonical SMILES for 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide is CCc1ccc(NS(=O)(=O)c2cc(C(=O)Nc3cccc(OC)c3)ccc2OC)cc1.
What is the InChIKey of 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide?
The InChIKey is ZQEWUHVXAIPWJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O5S/c1-4-16-8-11-18(12-9-16)25-31(27,28)22-14-17(10-13-21(22)30-3)23(26)24-19-6-5-7-20(15-19)29-2/h5-15,25H,4H2,1-3H3,(H,24,26).
What are the key properties of 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide?
3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide has a molecular weight of 440.52 g/mol, XLogP of 4.32, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethylphenyl)sulfamoyl]-4-methoxy-N-(3-methoxyphenyl)benzamide is sourced from PubChem (CID 17489130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).