F2691-0863
TL;DR: F2691-0863 (CAS 899981-98-7) is a chemical compound with molecular formula C20H23N5O3 and molecular weight 381.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-N-[(3,4-dimethoxyphenyl)methyl]-1-[(2-methylphenyl)methyl]triazole-4-carboxamide
Also Known As: F2691-0863, 5-amino-N-(3,4-dimethoxybenzyl)-1-(2-methylbenzyl)-1H-1,2,3-triazole-4-carboxamide, 5-amino-N-[(3,4-dimethoxyphenyl)methyl]-1-[(2-methylphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide, 5-amino-N-[(3,4-dimethoxyphenyl)methyl]-1-[(2-methylphenyl)methyl]triazole-4-carboxamide
| Molecular Formula | C20H23N5O3 |
|---|---|
| Molecular Weight | 381.18 g/mol |
| LogP | 2.16422 |
| Topological Polar Surface Area | 104.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 381.18008 |
| Heavy Atoms | 28 |
| Complexity | 983.72253 |
Chemical Identifiers
| CAS Number | 899981-98-7 |
|---|---|
| SMILES | CC1=CC=CC=C1CN2C(=C(N=N2)C(=O)NCC3=CC(=C(C=C3)OC)OC)N |
Product Overview
F2691-0863 (CAS 899981-98-7), with molecular formula C20H23N5O3 and molecular weight 381.18 g/mol. IUPAC: 5-amino-N-[(3,4-dimethoxyphenyl)methyl]-1-[(2-methylphenyl)methyl]triazole-4-carboxamide.
Chemical Property Profile of F2691-0863
Property Insights of F2691-0863
The XLogP value of 2.16422 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2691-0863. The TPSA of 104.29 Ų falls within the moderate polarity range, balancing permeability and solubility for F2691-0863. Following Lipinski's Rule of Five, F2691-0863 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 F2691-0863?
The CAS number of F2691-0863 is 899981-98-7.
What is the molecular formula of F2691-0863?
The molecular formula of F2691-0863 is C20H23N5O3.
What is the molecular weight of F2691-0863?
The molecular weight of F2691-0863 is 381.18 g/mol.
Where can I buy F2691-0863?
You can request a quote for F2691-0863 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2691-0863?
Yes, KEHONG BIO provides custom synthesis services for F2691-0863 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.