4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide

C23H24N2O3S — CID 9164353

IUPAC4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
SMILESCc1ccc(NS(=O)(=O)c2ccc(C(=O)NC[C@H](C)c3ccccc3)cc2)cc1
InChIInChI=1S/C23H24N2O3S/c1-17-8-12-21(13-9-17)25-29(27,28)22-14-10-20(11-15-22)23(26)24-16-18(2)19-6-4-3-5-7-19/h3-15,18,25H,16H2,1-2H3,(H,24,26)/t18-/m0/s1
InChIKeyMILFROLLJYTQOU-SFHVURJKSA-N
MW408.52 g/mol
LogP4.33
Rot. Bonds7

About 4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide

4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide (PubChem CID 9164353) has the molecular formula C23H24N2O3S and a molecular weight of 408.52 g/mol. Its IUPAC name is 4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide.

Molecular Properties

Compound Name4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
PubChem CID9164353
Molecular FormulaC23H24N2O3S
Molecular Weight408.52 g/mol
Exact Mass408.15
IUPAC Name4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
SMILESCc1ccc(NS(=O)(=O)c2ccc(C(=O)NC[C@H](C)c3ccccc3)cc2)cc1
InChIInChI=1S/C23H24N2O3S/c1-17-8-12-21(13-9-17)25-29(27,28)22-14-10-20(11-15-22)23(26)24-16-18(2)19-6-4-3-5-7-19/h3-15,18,25H,16H2,1-2H3,(H,24,26)/t18-/m0/s1
InChIKeyMILFROLLJYTQOU-SFHVURJKSA-N
XLogP4.33
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.52
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide
CID 9164346
4-methyl-N-[(2R)-2-phenylpropyl]benzamide
CID 9302175
N-(2-hydroxypropyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 78800316
4-[(2-methylphenyl)sulfamoyl]-N-[(2S)-2-phenylpropyl]benzamide
CID 9164348
4-(ethylsulfonylamino)-N-(2-phenylpropyl)benzamide
CID 133163901
4-chloro-3-[(4-methylphenyl)sulfamoyl]-N-(2-phenylpropyl)benzamide
CID 133229135
N-[(2R)-2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 25391278
4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide
CID 9301395
3-[(4-fluorophenyl)sulfamoyl]-N-[(2S)-2-phenylpropyl]benzamide
CID 9302470
4-methyl-N-[2-oxo-2-(2-phenylpropylamino)ethyl]benzamide
CID 17400864
4-(benzenesulfonamido)-N-[(2R)-2-(ethylamino)propyl]benzamide
CID 120653123
4-(benzenesulfonamido)-N-[2-(dimethylamino)-3-methylbutyl]benzamide
CID 24650129

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide?
The IUPAC name of 4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide (CID 9164353) is 4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide.
What is the SMILES notation for 4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide?
The canonical SMILES for 4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide is Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NC[C@H](C)c3ccccc3)cc2)cc1.
What is the InChIKey of 4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide?
The InChIKey is MILFROLLJYTQOU-SFHVURJKSA-N. The full InChI is InChI=1S/C23H24N2O3S/c1-17-8-12-21(13-9-17)25-29(27,28)22-14-10-20(11-15-22)23(26)24-16-18(2)19-6-4-3-5-7-19/h3-15,18,25H,16H2,1-2H3,(H,24,26)/t18-/m0/s1.
What are the key properties of 4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide?
4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide has a molecular weight of 408.52 g/mol, XLogP of 4.33, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide is sourced from PubChem (CID 9164353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).