N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide

C23H24N2O6S — CID 2116569

IUPACN-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
SMILESCOc1cc(NC(=O)c2ccc(S(=O)(=O)N(C)c3ccccc3OC)cc2)cc(OC)c1
InChIInChI=1S/C23H24N2O6S/c1-25(21-7-5-6-8-22(21)31-4)32(27,28)20-11-9-16(10-12-20)23(26)24-17-13-18(29-2)15-19(14-17)30-3/h5-15H,1-4H3,(H,24,26)
InChIKeyKZJCEYODQIREDD-UHFFFAOYSA-N
MW456.52 g/mol
LogP3.79
Rot. Bonds8

About N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide

N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide (PubChem CID 2116569) has the molecular formula C23H24N2O6S and a molecular weight of 456.52 g/mol. Its IUPAC name is N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide.

Molecular Properties

Compound NameN-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
PubChem CID2116569
Molecular FormulaC23H24N2O6S
Molecular Weight456.52 g/mol
Exact Mass456.14
IUPAC NameN-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
SMILESCOc1cc(NC(=O)c2ccc(S(=O)(=O)N(C)c3ccccc3OC)cc2)cc(OC)c1
InChIInChI=1S/C23H24N2O6S/c1-25(21-7-5-6-8-22(21)31-4)32(27,28)20-11-9-16(10-12-20)23(26)24-17-13-18(29-2)15-19(14-17)30-3/h5-15H,1-4H3,(H,24,26)
InChIKeyKZJCEYODQIREDD-UHFFFAOYSA-N
XLogP3.79
TPSA94.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.52
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide?
The IUPAC name of N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide (CID 2116569) is N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide.
What is the SMILES notation for N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide?
The canonical SMILES for N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide is COc1cc(NC(=O)c2ccc(S(=O)(=O)N(C)c3ccccc3OC)cc2)cc(OC)c1.
What is the InChIKey of N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide?
The InChIKey is KZJCEYODQIREDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O6S/c1-25(21-7-5-6-8-22(21)31-4)32(27,28)20-11-9-16(10-12-20)23(26)24-17-13-18(29-2)15-19(14-17)30-3/h5-15H,1-4H3,(H,24,26).
What are the key properties of N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide?
N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide has a molecular weight of 456.52 g/mol, XLogP of 3.79, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide is sourced from PubChem (CID 2116569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).