4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide

C24H23N3O4S — CID 55711862

IUPAC4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide
SMILESCc1ccc(NC(=O)C2CC2)cc1NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C24H23N3O4S/c1-16-7-12-20(25-23(28)17-8-9-17)15-22(16)26-24(29)18-10-13-19(14-11-18)27-32(30,31)21-5-3-2-4-6-21/h2-7,10-15,17,27H,8-9H2,1H3,(H,25,28)(H,26,29)
InChIKeyJYTHBFHTGZPQTL-UHFFFAOYSA-N
MW449.53 g/mol
LogP4.40
Rot. Bonds7

About 4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide

4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide (PubChem CID 55711862) has the molecular formula C24H23N3O4S and a molecular weight of 449.53 g/mol. Its IUPAC name is 4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide.

Molecular Properties

Compound Name4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide
PubChem CID55711862
Molecular FormulaC24H23N3O4S
Molecular Weight449.53 g/mol
Exact Mass449.14
IUPAC Name4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide
SMILESCc1ccc(NC(=O)C2CC2)cc1NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C24H23N3O4S/c1-16-7-12-20(25-23(28)17-8-9-17)15-22(16)26-24(29)18-10-13-19(14-11-18)27-32(30,31)21-5-3-2-4-6-21/h2-7,10-15,17,27H,8-9H2,1H3,(H,25,28)(H,26,29)
InChIKeyJYTHBFHTGZPQTL-UHFFFAOYSA-N
XLogP4.40
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.53
LogP ≤ 54.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 46467572
N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]-3-methylsulfonylbenzamide
CID 55711603
N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]-4-(2-methoxyethylsulfamoyl)benzamide
CID 46467570
N-[3-(benzenesulfonamido)-4-methylphenyl]-4-methylbenzamide
CID 55705717
4-cyclohexyl-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide
CID 46478092
4-(benzenesulfonamido)-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]benzamide
CID 17052595
N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]-5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzamide
CID 55725226
N-[4-[(cyclopropanecarbonylamino)carbamoyl]phenyl]benzenesulfonamide
CID 18106352
4-(benzenesulfonamido)-N-(2,3-dimethylphenyl)benzamide
CID 1252770
N-(5-acetamido-2-chlorophenyl)-4-(benzenesulfonamido)benzamide
CID 55981241
N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]-3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide
CID 55711809
2-[[4-(benzenesulfonamido)benzoyl]amino]-N-cyclopropylbenzamide
CID 34281161

Frequently Asked Questions

What is the IUPAC name of 4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide?
The IUPAC name of 4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide (CID 55711862) is 4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide.
What is the SMILES notation for 4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide?
The canonical SMILES for 4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide is Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of 4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide?
The InChIKey is JYTHBFHTGZPQTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O4S/c1-16-7-12-20(25-23(28)17-8-9-17)15-22(16)26-24(29)18-10-13-19(14-11-18)27-32(30,31)21-5-3-2-4-6-21/h2-7,10-15,17,27H,8-9H2,1H3,(H,25,28)(H,26,29).
What are the key properties of 4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide?
4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide has a molecular weight of 449.53 g/mol, XLogP of 4.40, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzenesulfonamido)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide is sourced from PubChem (CID 55711862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).