N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide

C23H24N2O5S — CID 25497844

IUPACN-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N(C)Cc2ccccc2OC)cc1
InChIInChI=1S/C23H24N2O5S/c1-25(16-17-8-4-7-11-22(17)30-3)23(26)20-9-5-6-10-21(20)24-31(27,28)19-14-12-18(29-2)13-15-19/h4-15,24H,16H2,1-3H3
InChIKeyGKAHRYZBWCSQNV-UHFFFAOYSA-N
MW440.52 g/mol
LogP3.78
Rot. Bonds8

About N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide

N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide (PubChem CID 25497844) has the molecular formula C23H24N2O5S and a molecular weight of 440.52 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide
PubChem CID25497844
Molecular FormulaC23H24N2O5S
Molecular Weight440.52 g/mol
Exact Mass440.14
IUPAC NameN-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N(C)Cc2ccccc2OC)cc1
InChIInChI=1S/C23H24N2O5S/c1-25(16-17-8-4-7-11-22(17)30-3)23(26)20-9-5-6-10-21(20)24-31(27,28)19-14-12-18(29-2)13-15-19/h4-15,24H,16H2,1-3H3
InChIKeyGKAHRYZBWCSQNV-UHFFFAOYSA-N
XLogP3.78
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.52
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide (CID 25497844) is N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide is COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N(C)Cc2ccccc2OC)cc1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide?
The InChIKey is GKAHRYZBWCSQNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O5S/c1-25(16-17-8-4-7-11-22(17)30-3)23(26)20-9-5-6-10-21(20)24-31(27,28)19-14-12-18(29-2)13-15-19/h4-15,24H,16H2,1-3H3.
What are the key properties of N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide?
N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide has a molecular weight of 440.52 g/mol, XLogP of 3.78, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide is sourced from PubChem (CID 25497844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).