3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide

C26H30N4O3S — CID 24588553

IUPAC3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide
SMILESNS(=O)(=O)c1ccc(NC(=O)CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1
InChIInChI=1S/C26H30N4O3S/c27-34(32,33)24-13-11-23(12-14-24)28-25(31)15-16-29-17-19-30(20-18-29)26(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,26H,15-20H2,(H,28,31)(H2,27,32,33)
InChIKeyCGCZJXMAHBIHPL-UHFFFAOYSA-N
MW478.62 g/mol
LogP3.07
Rot. Bonds8

About 3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide

3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide (PubChem CID 24588553) has the molecular formula C26H30N4O3S and a molecular weight of 478.62 g/mol. Its IUPAC name is 3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide.

Molecular Properties

Compound Name3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide
PubChem CID24588553
Molecular FormulaC26H30N4O3S
Molecular Weight478.62 g/mol
Exact Mass478.20
IUPAC Name3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide
SMILESNS(=O)(=O)c1ccc(NC(=O)CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1
InChIInChI=1S/C26H30N4O3S/c27-34(32,33)24-13-11-23(12-14-24)28-25(31)15-16-29-17-19-30(20-18-29)26(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,26H,15-20H2,(H,28,31)(H2,27,32,33)
InChIKeyCGCZJXMAHBIHPL-UHFFFAOYSA-N
XLogP3.07
TPSA95.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500478.62
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide 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

2-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide
CID 42996416
3-(4-benzoylpiperidin-1-yl)-N-(4-sulfamoylphenyl)propanamide
CID 33215032
N,N-dimethyl-4-[3-oxo-3-(4-sulfamoylanilino)propyl]piperazine-1-carboxamide
CID 55648530
2-(4-benzhydrylpiperazin-1-yl)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 4642015
N-benzyl-1-[3-oxo-3-(4-sulfamoylanilino)propyl]piperidine-4-carboxamide
CID 24589298
3-(4-benzhydrylpiperazin-1-yl)-N-propan-2-ylpropanamide
CID 33177312
3-(4-benzhydrylpiperazin-1-yl)-N-(2-oxochromen-6-yl)propanamide
CID 176507451
3-[4-(3,5-dimethylbenzoyl)piperazin-1-yl]-N-(4-sulfamoylphenyl)propanamide
CID 30871597
N-(3-chlorophenyl)-3-[4-(4-sulfamoylphenyl)piperazin-1-yl]propanamide
CID 60500788
1-[3-(4-benzhydrylpiperazin-1-yl)propyl]-3-phenylurea
CID 110173228
3-amino-N-(4-sulfamoylphenyl)propanamide
CID 10776616
2-(4-benzhydrylpiperazin-1-yl)-N-(4-nitrophenyl)acetamide
CID 22198313

Frequently Asked Questions

What is the IUPAC name of 3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide?
The IUPAC name of 3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide (CID 24588553) is 3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide.
What is the SMILES notation for 3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide?
The canonical SMILES for 3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide is NS(=O)(=O)c1ccc(NC(=O)CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1.
What is the InChIKey of 3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide?
The InChIKey is CGCZJXMAHBIHPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N4O3S/c27-34(32,33)24-13-11-23(12-14-24)28-25(31)15-16-29-17-19-30(20-18-29)26(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,26H,15-20H2,(H,28,31)(H2,27,32,33).
What are the key properties of 3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide?
3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide has a molecular weight of 478.62 g/mol, XLogP of 3.07, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide is sourced from PubChem (CID 24588553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).