Benzamil
TL;DR: Benzamil (CAS 2898-76-2) is a chemical compound with molecular formula C13H14ClN7O and molecular weight 319.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-diamino-N-(N'-benzylcarbamimidoyl)-6-chloropyrazine-2-carboxamide
Also Known As: Benzamil, Benzylamiloride, Benzamil hydrochloride, benzamil amiloride, BenzamilHCl
| Molecular Formula | C13H14ClN7O |
|---|---|
| Molecular Weight | 319.09 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.09485 |
| Heavy Atoms | 22 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 2898-76-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN=C(N)NC(=O)C2=C(N=C(C(=N2)Cl)N)N |
| InChIKey | KXDROGADUISDGY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzamil (CAS 2898-76-2), with molecular formula C13H14ClN7O and molecular weight 319.09 g/mol. IUPAC: 3,5-diamino-N-(N'-benzylcarbamimidoyl)-6-chloropyrazine-2-carboxamide.
Chemical Property Profile of Benzamil
Property Insights of Benzamil
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzamil. The TPSA of 145.0 Ų indicates high polarity, suggesting Benzamil may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzamil has 4 hydrogen bond donor(s) and 6 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 Benzamil?
The CAS number of Benzamil is 2898-76-2.
What is the molecular formula of Benzamil?
The molecular formula of Benzamil is C13H14ClN7O.
What is the molecular weight of Benzamil?
The molecular weight of Benzamil is 319.09 g/mol.
Where can I buy Benzamil?
You can request a quote for Benzamil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzamil?
Yes, KEHONG BIO provides custom synthesis services for Benzamil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.