F1609-0596
TL;DR: F1609-0596 (CAS 895651-71-5) is a chemical compound with molecular formula C21H24N6O2 and molecular weight 392.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-1-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-(2-phenylethyl)triazole-4-carboxamide
Also Known As: F1609-0596, 5-amino-1-{[(2,3-dimethylphenyl)carbamoyl]methyl}-N-(2-phenylethyl)-1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-(2-phenylethyl)triazole-4-carboxamide, 5-amino-1-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-phenethyltriazole-4-carboxamide, N-phenethyl-5-amino-1-[(N-2,3-xylylcarbamoyl)methyl]-1H-1,2,3-triazole-4-carboxamide
| Molecular Formula | C21H24N6O2 |
|---|---|
| Molecular Weight | 392.20 g/mol |
| LogP | 2.08834 |
| Topological Polar Surface Area | 114.93 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 392.19608 |
| Heavy Atoms | 29 |
| Complexity | 1013.26575 |
Chemical Identifiers
| CAS Number | 895651-71-5 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=O)CN2C(=C(N=N2)C(=O)NCCC3=CC=CC=C3)N)C |
Product Overview
F1609-0596 (CAS 895651-71-5), with molecular formula C21H24N6O2 and molecular weight 392.20 g/mol. IUPAC: 5-amino-1-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-(2-phenylethyl)triazole-4-carboxamide.
Chemical Property Profile of F1609-0596
Property Insights of F1609-0596
The XLogP value of 2.08834 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1609-0596. The TPSA of 114.93 Ų falls within the moderate polarity range, balancing permeability and solubility for F1609-0596. Following Lipinski's Rule of Five, F1609-0596 has 3 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 F1609-0596?
The CAS number of F1609-0596 is 895651-71-5.
What is the molecular formula of F1609-0596?
The molecular formula of F1609-0596 is C21H24N6O2.
What is the molecular weight of F1609-0596?
The molecular weight of F1609-0596 is 392.20 g/mol.
Where can I buy F1609-0596?
You can request a quote for F1609-0596 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1609-0596?
Yes, KEHONG BIO provides custom synthesis services for F1609-0596 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.