Nilprazole
TL;DR: Nilprazole (CAS 60662-19-3) is a chemical compound with molecular formula C26H33N5O2 and molecular weight 447.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[[1-(3-oxo-3-phenylpropyl)benzimidazol-2-yl]methyl]piperazin-1-yl]-N-propan-2-ylacetamide
Also Known As: Nilprazole, Nilprazol, Nilprazolum, Nilprazole [INN:BAN], Nilprazol [INN-Spanish]
| Molecular Formula | C26H33N5O2 |
|---|---|
| Molecular Weight | 447.26 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 447.26343 |
| Heavy Atoms | 33 |
| Complexity | 643.0 |
Chemical Identifiers
| CAS Number | 60662-19-3 |
|---|---|
| SMILES | CC(C)NC(=O)CN1CCN(CC1)CC2=NC3=CC=CC=C3N2CCC(=O)C4=CC=CC=C4 |
| InChIKey | GPFJNGJUUKBSLS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nilprazole (CAS 60662-19-3), with molecular formula C26H33N5O2 and molecular weight 447.26 g/mol. IUPAC: 2-[4-[[1-(3-oxo-3-phenylpropyl)benzimidazol-2-yl]methyl]piperazin-1-yl]-N-propan-2-ylacetamide.
Chemical Property Profile of Nilprazole
Property Insights of Nilprazole
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nilprazole. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Nilprazole. Following Lipinski's Rule of Five, Nilprazole has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nilprazole?
The CAS number of Nilprazole is 60662-19-3.
What is the molecular formula of Nilprazole?
The molecular formula of Nilprazole is C26H33N5O2.
What is the molecular weight of Nilprazole?
The molecular weight of Nilprazole is 447.26 g/mol.
Where can I buy Nilprazole?
You can request a quote for Nilprazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nilprazole?
Yes, KEHONG BIO provides custom synthesis services for Nilprazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.