F2691-0684
TL;DR: F2691-0684 (CAS 899981-83-0) is a chemical compound with molecular formula C21H25N5O and molecular weight 363.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-1-[(2,5-dimethylphenyl)methyl]-N-(4-propan-2-ylphenyl)triazole-4-carboxamide
Also Known As: F2691-0684, 5-amino-1-(2,5-dimethylbenzyl)-N-[4-(propan-2-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(2,5-dimethylphenyl)methyl]-N-(4-propan-2-ylphenyl)triazole-4-carboxamide, 5-amino-1-(2,5-dimethylbenzyl)-N-(4-isopropylphenyl)-1H-1,2,3-triazole-4-carboxamide
| Molecular Formula | C21H25N5O |
|---|---|
| Molecular Weight | 363.21 g/mol |
| LogP | 3.90114 |
| Topological Polar Surface Area | 85.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.2059 |
| Heavy Atoms | 27 |
| Complexity | 957.20337 |
Chemical Identifiers
| CAS Number | 899981-83-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)CN2C(=C(N=N2)C(=O)NC3=CC=C(C=C3)C(C)C)N |
Product Overview
F2691-0684 (CAS 899981-83-0), with molecular formula C21H25N5O and molecular weight 363.21 g/mol. IUPAC: 5-amino-1-[(2,5-dimethylphenyl)methyl]-N-(4-propan-2-ylphenyl)triazole-4-carboxamide.
Chemical Property Profile of F2691-0684
Property Insights of F2691-0684
The XLogP value of 3.90114 indicates that F2691-0684 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.83 Ų falls within the moderate polarity range, balancing permeability and solubility for F2691-0684. Following Lipinski's Rule of Five, F2691-0684 has 2 hydrogen bond donor(s) and 4 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 F2691-0684?
The CAS number of F2691-0684 is 899981-83-0.
What is the molecular formula of F2691-0684?
The molecular formula of F2691-0684 is C21H25N5O.
What is the molecular weight of F2691-0684?
The molecular weight of F2691-0684 is 363.21 g/mol.
Where can I buy F2691-0684?
You can request a quote for F2691-0684 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2691-0684?
Yes, KEHONG BIO provides custom synthesis services for F2691-0684 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.