F1609-0594
TL;DR: F1609-0594 (CAS 895651-65-7) is a chemical compound with molecular formula C20H22N6O2 and molecular weight 378.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-N-benzyl-1-[2-(2,3-dimethylanilino)-2-oxoethyl]triazole-4-carboxamide
Also Known As: F1609-0594, 5-amino-N-benzyl-1-[2-(2,3-dimethylanilino)-2-oxoethyl]triazole-4-carboxamide, 5-amino-N-benzyl-1-(2-((2,3-dimethylphenyl)amino)-2-oxoethyl)-1H-1,2,3-triazole-4-carboxamide, 5-AMINO-N-BENZYL-1-{[(2,3-DIMETHYLPHENYL)CARBAMOYL]METHYL}-1H-1,2,3-TRIAZOLE-4-CARBOXAMIDE
| Molecular Formula | C20H22N6O2 |
|---|---|
| Molecular Weight | 378.18 g/mol |
| LogP | 2.04584 |
| Topological Polar Surface Area | 114.93 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.18042 |
| Heavy Atoms | 28 |
| Complexity | 997.1854 |
Chemical Identifiers
| CAS Number | 895651-65-7 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=O)CN2C(=C(N=N2)C(=O)NCC3=CC=CC=C3)N)C |
Product Overview
F1609-0594 (CAS 895651-65-7), with molecular formula C20H22N6O2 and molecular weight 378.18 g/mol. IUPAC: 5-amino-N-benzyl-1-[2-(2,3-dimethylanilino)-2-oxoethyl]triazole-4-carboxamide.
Chemical Property Profile of F1609-0594
Property Insights of F1609-0594
The XLogP value of 2.04584 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1609-0594. The TPSA of 114.93 Ų falls within the moderate polarity range, balancing permeability and solubility for F1609-0594. Following Lipinski's Rule of Five, F1609-0594 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 F1609-0594?
The CAS number of F1609-0594 is 895651-65-7.
What is the molecular formula of F1609-0594?
The molecular formula of F1609-0594 is C20H22N6O2.
What is the molecular weight of F1609-0594?
The molecular weight of F1609-0594 is 378.18 g/mol.
Where can I buy F1609-0594?
You can request a quote for F1609-0594 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1609-0594?
Yes, KEHONG BIO provides custom synthesis services for F1609-0594 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.