2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide

C23H23N3O4S — CID 2979282

IUPAC2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccccc1NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C23H23N3O4S/c1-16(2)24-23(28)20-10-6-7-11-21(20)25-22(27)17-12-14-18(15-13-17)26-31(29,30)19-8-4-3-5-9-19/h3-16,26H,1-2H3,(H,24,28)(H,25,27)
InChIKeyKYDSUHSDDRLAEF-UHFFFAOYSA-N
MW437.52 g/mol
LogP3.88
Rot. Bonds7

About 2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide

2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide (PubChem CID 2979282) has the molecular formula C23H23N3O4S and a molecular weight of 437.52 g/mol. Its IUPAC name is 2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide
PubChem CID2979282
Molecular FormulaC23H23N3O4S
Molecular Weight437.52 g/mol
Exact Mass437.14
IUPAC Name2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccccc1NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C23H23N3O4S/c1-16(2)24-23(28)20-10-6-7-11-21(20)25-22(27)17-12-14-18(15-13-17)26-31(29,30)19-8-4-3-5-9-19/h3-16,26H,1-2H3,(H,24,28)(H,25,27)
InChIKeyKYDSUHSDDRLAEF-UHFFFAOYSA-N
XLogP3.88
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.52
LogP ≤ 53.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[4-(benzenesulfonamido)benzoyl]amino]-N-cyclopropylbenzamide
CID 34281161
2-[[3-(benzenesulfonamido)benzoyl]amino]-N-[(2R)-butan-2-yl]benzamide
CID 41466932
4-(benzenesulfonamido)-N-(2,3-dimethylphenyl)benzamide
CID 1252770
2-[[2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]acetyl]amino]-N-propan-2-ylbenzamide
CID 34556664
2-[[4-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzamide
CID 53279919
N-butan-2-yl-2-[[4-(methanesulfonamido)benzoyl]amino]benzamide
CID 2968059
4-(benzenesulfonamido)-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]benzamide
CID 17052595
4-[(4-chlorophenyl)sulfonylamino]-N-(2-methylsulfanylphenyl)benzamide
CID 41318735
4-[(3,4-dimethylphenyl)sulfonylamino]-N-[2-(propan-2-ylcarbamoylamino)phenyl]benzamide
CID 55964177
4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide
CID 6459980
4-(benzenesulfonamido)-N-[4-[4-[[4-(benzenesulfonamido)benzoyl]amino]-3-methoxyphenyl]-2-methoxyphenyl]benzamide
CID 121043668
N-[2-(benzenesulfonamido)phenyl]-4-(methoxymethyl)benzamide
CID 49202399

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide?
The IUPAC name of 2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide (CID 2979282) is 2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide.
What is the SMILES notation for 2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide?
The canonical SMILES for 2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide is CC(C)NC(=O)c1ccccc1NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of 2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide?
The InChIKey is KYDSUHSDDRLAEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O4S/c1-16(2)24-23(28)20-10-6-7-11-21(20)25-22(27)17-12-14-18(15-13-17)26-31(29,30)19-8-4-3-5-9-19/h3-16,26H,1-2H3,(H,24,28)(H,25,27).
What are the key properties of 2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide?
2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide has a molecular weight of 437.52 g/mol, XLogP of 3.88, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(benzenesulfonamido)benzoyl]amino]-N-propan-2-ylbenzamide is sourced from PubChem (CID 2979282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).