N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide

C19H24N2O5S2 — CID 17225015

IUPACN-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide
SMILESCCCNS(=O)(=O)c1ccc(NC(=O)c2ccccc2S(=O)(=O)CCC)cc1
InChIInChI=1S/C19H24N2O5S2/c1-3-13-20-28(25,26)16-11-9-15(10-12-16)21-19(22)17-7-5-6-8-18(17)27(23,24)14-4-2/h5-12,20H,3-4,13-14H2,1-2H3,(H,21,22)
InChIKeyNYMKXVVRCNEMBA-UHFFFAOYSA-N
MW424.54 g/mol
LogP2.81
Rot. Bonds9

About N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide

N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide (PubChem CID 17225015) has the molecular formula C19H24N2O5S2 and a molecular weight of 424.54 g/mol. Its IUPAC name is N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide.

Molecular Properties

Compound NameN-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide
PubChem CID17225015
Molecular FormulaC19H24N2O5S2
Molecular Weight424.54 g/mol
Exact Mass424.11
IUPAC NameN-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide
SMILESCCCNS(=O)(=O)c1ccc(NC(=O)c2ccccc2S(=O)(=O)CCC)cc1
InChIInChI=1S/C19H24N2O5S2/c1-3-13-20-28(25,26)16-11-9-15(10-12-16)21-19(22)17-7-5-6-8-18(17)27(23,24)14-4-2/h5-12,20H,3-4,13-14H2,1-2H3,(H,21,22)
InChIKeyNYMKXVVRCNEMBA-UHFFFAOYSA-N
XLogP2.81
TPSA109.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.54
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(2-phenylethylsulfamoyl)phenyl]-2-propylsulfonylbenzamide
CID 17224948
N-(4-acetamidophenyl)-2-propylsulfonylbenzamide
CID 17224883
2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 34174804
2-ethylsulfonyl-N-(4-methylsulfonylphenyl)benzamide
CID 9455909
2-propylsulfonyl-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 55678185
N-[4-(butylsulfamoyl)phenyl]-2-methylbenzamide
CID 4278982
2-bromo-N-[4-(butylsulfamoyl)phenyl]benzamide
CID 2162853
propyl 4-[(2-propylsulfonylbenzoyl)amino]benzoate
CID 17224802
2-(2-phenoxyethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 4954384
N-[4-(butylsulfamoyl)phenyl]-2-[[2-[[4-(butylsulfamoyl)phenyl]carbamoyl]phenyl]diselanyl]benzamide
CID 10724138
2,5-dichloro-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 17320181
2,4-dimethyl-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 38352261

Frequently Asked Questions

What is the IUPAC name of N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide?
The IUPAC name of N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide (CID 17225015) is N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide.
What is the SMILES notation for N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide?
The canonical SMILES for N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide is CCCNS(=O)(=O)c1ccc(NC(=O)c2ccccc2S(=O)(=O)CCC)cc1.
What is the InChIKey of N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide?
The InChIKey is NYMKXVVRCNEMBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5S2/c1-3-13-20-28(25,26)16-11-9-15(10-12-16)21-19(22)17-7-5-6-8-18(17)27(23,24)14-4-2/h5-12,20H,3-4,13-14H2,1-2H3,(H,21,22).
What are the key properties of N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide?
N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide has a molecular weight of 424.54 g/mol, XLogP of 2.81, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide is sourced from PubChem (CID 17225015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).