F2691-0489
TL;DR: F2691-0489 (CAS 899981-55-6) is a chemical compound with molecular formula C18H18ClN5O2 and molecular weight 371.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-1-[(2-chlorophenyl)methyl]-N-(2-methoxy-5-methylphenyl)triazole-4-carboxamide
Also Known As: F2691-0489, 5-amino-1-(2-chlorobenzyl)-N-(2-methoxy-5-methylphenyl)-1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(2-chlorophenyl)methyl]-N-(2-methoxy-5-methylphenyl)triazole-4-carboxamide, 5-amino-1-[(2-chlorophenyl)methyl]-N-(2-methoxy-5-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
| Molecular Formula | C18H18ClN5O2 |
|---|---|
| Molecular Weight | 371.11 g/mol |
| LogP | 3.13132 |
| Topological Polar Surface Area | 95.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.1149 |
| Heavy Atoms | 26 |
| Complexity | 954.5046 |
Chemical Identifiers
| CAS Number | 899981-55-6 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC)NC(=O)C2=C(N(N=N2)CC3=CC=CC=C3Cl)N |
Product Overview
F2691-0489 (CAS 899981-55-6), with molecular formula C18H18ClN5O2 and molecular weight 371.11 g/mol. IUPAC: 5-amino-1-[(2-chlorophenyl)methyl]-N-(2-methoxy-5-methylphenyl)triazole-4-carboxamide.
Chemical Property Profile of F2691-0489
Property Insights of F2691-0489
The XLogP value of 3.13132 indicates that F2691-0489 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.06 Ų falls within the moderate polarity range, balancing permeability and solubility for F2691-0489. Following Lipinski's Rule of Five, F2691-0489 has 2 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 F2691-0489?
The CAS number of F2691-0489 is 899981-55-6.
What is the molecular formula of F2691-0489?
The molecular formula of F2691-0489 is C18H18ClN5O2.
What is the molecular weight of F2691-0489?
The molecular weight of F2691-0489 is 371.11 g/mol.
Where can I buy F2691-0489?
You can request a quote for F2691-0489 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2691-0489?
Yes, KEHONG BIO provides custom synthesis services for F2691-0489 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.