F2691-0290
TL;DR: F2691-0290 (CAS 899981-40-9) is a chemical compound with molecular formula C18H18ClN5O3 and molecular weight 387.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-1-[(3-chlorophenyl)methyl]-N-(3,5-dimethoxyphenyl)triazole-4-carboxamide
Also Known As: F2691-0290, 5-amino-1-(3-chlorobenzyl)-N-(3,5-dimethoxyphenyl)-1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(3-chlorophenyl)methyl]-N-(3,5-dimethoxyphenyl)-1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(3-chlorophenyl)methyl]-N-(3,5-dimethoxyphenyl)triazole-4-carboxamide
| Molecular Formula | C18H18ClN5O3 |
|---|---|
| Molecular Weight | 387.11 g/mol |
| LogP | 2.8315 |
| Topological Polar Surface Area | 104.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.1098 |
| Heavy Atoms | 27 |
| Complexity | 951.131 |
Chemical Identifiers
| CAS Number | 899981-40-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)NC(=O)C2=C(N(N=N2)CC3=CC(=CC=C3)Cl)N)OC |
Product Overview
F2691-0290 (CAS 899981-40-9), with molecular formula C18H18ClN5O3 and molecular weight 387.11 g/mol. IUPAC: 5-amino-1-[(3-chlorophenyl)methyl]-N-(3,5-dimethoxyphenyl)triazole-4-carboxamide.
Chemical Property Profile of F2691-0290
Property Insights of F2691-0290
The XLogP value of 2.8315 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2691-0290. The TPSA of 104.29 Ų falls within the moderate polarity range, balancing permeability and solubility for F2691-0290. Following Lipinski's Rule of Five, F2691-0290 has 2 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 F2691-0290?
The CAS number of F2691-0290 is 899981-40-9.
What is the molecular formula of F2691-0290?
The molecular formula of F2691-0290 is C18H18ClN5O3.
What is the molecular weight of F2691-0290?
The molecular weight of F2691-0290 is 387.11 g/mol.
Where can I buy F2691-0290?
You can request a quote for F2691-0290 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2691-0290?
Yes, KEHONG BIO provides custom synthesis services for F2691-0290 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.