N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide

C23H24N2O5S — CID 132672025

IUPACN-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(C(C)NC(=O)c2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2)cc1
InChIInChI=1S/C23H24N2O5S/c1-16(17-6-10-20(29-2)11-7-17)24-23(26)18-4-8-19(9-5-18)25-31(27,28)22-14-12-21(30-3)13-15-22/h4-16,25H,1-3H3,(H,24,26)
InChIKeyVJDLSVUTSUOLMN-UHFFFAOYSA-N
MW440.52 g/mol
LogP4.00
Rot. Bonds8

About N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide

N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide (PubChem CID 132672025) has the molecular formula C23H24N2O5S and a molecular weight of 440.52 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide
PubChem CID132672025
Molecular FormulaC23H24N2O5S
Molecular Weight440.52 g/mol
Exact Mass440.14
IUPAC NameN-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(C(C)NC(=O)c2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2)cc1
InChIInChI=1S/C23H24N2O5S/c1-16(17-6-10-20(29-2)11-7-17)24-23(26)18-4-8-19(9-5-18)25-31(27,28)22-14-12-21(30-3)13-15-22/h4-16,25H,1-3H3,(H,24,26)
InChIKeyVJDLSVUTSUOLMN-UHFFFAOYSA-N
XLogP4.00
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 ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1S)-1-(4-methoxyphenyl)ethyl]-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 92681084
4-(ethylsulfonylamino)-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 94027949
1-N,4-N-bis[(1S)-1-(4-methoxyphenyl)ethyl]benzene-1,4-dicarboxamide
CID 2211003
4-[(4-methoxyphenyl)sulfamoyl]-N-[(1S)-1-pyridin-2-ylethyl]benzamide
CID 25391222
N-[1-(4-methoxyphenyl)ethyl]-3-(phenylsulfamoyl)benzamide
CID 132663597
4-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[1-(4-methylphenyl)ethyl]benzamide
CID 132671525
4-(phenylsulfamoyl)-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]benzamide
CID 2446305
4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 9315283
4-[(4-bromophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 2090399
4-[(4-fluorophenyl)sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide
CID 9315282
4-(phenylsulfamoyl)-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]benzamide
CID 2446308
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-[4-[(4-methylphenyl)sulfamoyl]phenoxy]acetamide
CID 28553030

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide?
The IUPAC name of N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide (CID 132672025) is N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide is COc1ccc(C(C)NC(=O)c2ccc(NS(=O)(=O)c3ccc(OC)cc3)cc2)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide?
The InChIKey is VJDLSVUTSUOLMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O5S/c1-16(17-6-10-20(29-2)11-7-17)24-23(26)18-4-8-19(9-5-18)25-31(27,28)22-14-12-21(30-3)13-15-22/h4-16,25H,1-3H3,(H,24,26).
What are the key properties of N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide?
N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide has a molecular weight of 440.52 g/mol, XLogP of 4.00, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 132672025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).