5-N-(3-aminophenyl)amiloride
TL;DR: 5-N-(3-aminophenyl)amiloride (CAS 108414-87-5) is a chemical compound with molecular formula C12H13ClN8O and molecular weight 320.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5-(3-aminoanilino)-6-chloro-N-(diaminomethylidene)pyrazine-2-carboxamide
Also Known As: 5-N-(3-Aminophenyl)amiloride, 3-amino-5-(3-aminoanilino)-6-chloro-N-(diaminomethylidene)pyrazine-2-carboxamide, 3-Amino-N-(aminoiminomethyl)-5-((3-aminophenyl)amino)-6-chloropyrazinecarboxamide, Pyrazinecarboxamide, 3-amino-N-(aminoiminomethyl)-5-((3-aminophenyl)amino)-6-chloro-, RefChem:103232
| Molecular Formula | C12H13ClN8O |
|---|---|
| Molecular Weight | 320.09 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 171.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.0901 |
| Heavy Atoms | 22 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 108414-87-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC2=NC(=C(N=C2Cl)C(=O)N=C(N)N)N)N |
| InChIKey | DMGLDYFGHJWMJJ-UHFFFAOYSA-N |
Product Overview
5-N-(3-aminophenyl)amiloride (CAS 108414-87-5), with molecular formula C12H13ClN8O and molecular weight 320.09 g/mol. IUPAC: 3-amino-5-(3-aminoanilino)-6-chloro-N-(diaminomethylidene)pyrazine-2-carboxamide.
Chemical Property Profile of 5-N-(3-aminophenyl)amiloride
Property Insights of 5-N-(3-aminophenyl)amiloride
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-N-(3-aminophenyl)amiloride. The TPSA of 171.0 Ų indicates high polarity, suggesting 5-N-(3-aminophenyl)amiloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-N-(3-aminophenyl)amiloride has 5 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 5-N-(3-aminophenyl)amiloride?
The CAS number of 5-N-(3-aminophenyl)amiloride is 108414-87-5.
What is the molecular formula of 5-N-(3-aminophenyl)amiloride?
The molecular formula of 5-N-(3-aminophenyl)amiloride is C12H13ClN8O.
What is the molecular weight of 5-N-(3-aminophenyl)amiloride?
The molecular weight of 5-N-(3-aminophenyl)amiloride is 320.09 g/mol.
Where can I buy 5-N-(3-aminophenyl)amiloride?
You can request a quote for 5-N-(3-aminophenyl)amiloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-N-(3-aminophenyl)amiloride?
Yes, KEHONG BIO provides custom synthesis services for 5-N-(3-aminophenyl)amiloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.