N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide

C21H20N2O5S — CID 26538254

IUPACN-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
SMILESCOc1ccccc1NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C21H20N2O5S/c1-27-19-12-5-3-10-17(19)22-21(24)15-8-7-9-16(14-15)29(25,26)23-18-11-4-6-13-20(18)28-2/h3-14,23H,1-2H3,(H,22,24)
InChIKeyWZGGMUSDSPVMHQ-UHFFFAOYSA-N
MW412.47 g/mol
LogP3.76
Rot. Bonds7

About N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide

N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide (PubChem CID 26538254) has the molecular formula C21H20N2O5S and a molecular weight of 412.47 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
PubChem CID26538254
Molecular FormulaC21H20N2O5S
Molecular Weight412.47 g/mol
Exact Mass412.11
IUPAC NameN-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
SMILESCOc1ccccc1NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C21H20N2O5S/c1-27-19-12-5-3-10-17(19)22-21(24)15-8-7-9-16(14-15)29(25,26)23-18-11-4-6-13-20(18)28-2/h3-14,23H,1-2H3,(H,22,24)
InChIKeyWZGGMUSDSPVMHQ-UHFFFAOYSA-N
XLogP3.76
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.47
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide?
The IUPAC name of N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide (CID 26538254) is N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide is COc1ccccc1NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1.
What is the InChIKey of N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide?
The InChIKey is WZGGMUSDSPVMHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O5S/c1-27-19-12-5-3-10-17(19)22-21(24)15-8-7-9-16(14-15)29(25,26)23-18-11-4-6-13-20(18)28-2/h3-14,23H,1-2H3,(H,22,24).
What are the key properties of N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide?
N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide has a molecular weight of 412.47 g/mol, XLogP of 3.76, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 26538254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).