N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide

C23H24N2O4S — CID 45373733

IUPACN-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide
SMILESCCNS(=O)(=O)c1cc(C(=O)NC(c2ccccc2)c2ccccc2)ccc1OC
InChIInChI=1S/C23H24N2O4S/c1-3-24-30(27,28)21-16-19(14-15-20(21)29-2)23(26)25-22(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-16,22,24H,3H2,1-2H3,(H,25,26)
InChIKeyDWHJUTOFZWDOPT-UHFFFAOYSA-N
MW424.52 g/mol
LogP3.51
Rot. Bonds8

About N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide

N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide (PubChem CID 45373733) has the molecular formula C23H24N2O4S and a molecular weight of 424.52 g/mol. Its IUPAC name is N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide.

Molecular Properties

Compound NameN-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide
PubChem CID45373733
Molecular FormulaC23H24N2O4S
Molecular Weight424.52 g/mol
Exact Mass424.15
IUPAC NameN-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide
SMILESCCNS(=O)(=O)c1cc(C(=O)NC(c2ccccc2)c2ccccc2)ccc1OC
InChIInChI=1S/C23H24N2O4S/c1-3-24-30(27,28)21-16-19(14-15-20(21)29-2)23(26)25-22(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-16,22,24H,3H2,1-2H3,(H,25,26)
InChIKeyDWHJUTOFZWDOPT-UHFFFAOYSA-N
XLogP3.51
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.52
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-butan-2-yl-3-(ethylsulfamoyl)-4-methoxybenzamide
CID 17027131
3-(ethylsulfamoyl)-4-methoxy-N-[(2S)-pentan-2-yl]benzamide
CID 25419357
4-methoxy-N-(1-phenylbutyl)-3-(propan-2-ylsulfamoyl)benzamide
CID 46655114
N-(2,6-difluorophenyl)-3-(ethylsulfamoyl)-4-methoxybenzamide
CID 17027144
3-(benzylsulfamoyl)-N-[(1S)-1-(3,4-dimethoxyphenyl)ethyl]-4-methoxybenzamide
CID 28557712
3-(ethylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide
CID 45373616
3-(ethylsulfamoyl)-4-methoxy-N-[2-(trifluoromethyl)phenyl]benzamide
CID 45373661
3-(benzylsulfamoyl)-4-methoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]benzamide
CID 28557709
4-methoxy-3-(2-methoxyethylsulfamoyl)-N-(2-phenylbutyl)benzamide
CID 24548500
N,N-diethyl-3-(ethylsulfamoyl)-4-methoxybenzamide
CID 45373689
N-[1-(3-bromophenyl)ethyl]-4-methoxy-3-(propylsulfamoyl)benzamide
CID 43874000
4-methoxy-3-methyl-N-[(R)-(4-methylphenyl)-phenylmethyl]benzamide
CID 100771245

Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide?
The IUPAC name of N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide (CID 45373733) is N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide.
What is the SMILES notation for N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide?
The canonical SMILES for N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide is CCNS(=O)(=O)c1cc(C(=O)NC(c2ccccc2)c2ccccc2)ccc1OC.
What is the InChIKey of N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide?
The InChIKey is DWHJUTOFZWDOPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4S/c1-3-24-30(27,28)21-16-19(14-15-20(21)29-2)23(26)25-22(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-16,22,24H,3H2,1-2H3,(H,25,26).
What are the key properties of N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide?
N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide has a molecular weight of 424.52 g/mol, XLogP of 3.51, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-3-(ethylsulfamoyl)-4-methoxybenzamide is sourced from PubChem (CID 45373733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).