F0656-0172
TL;DR: F0656-0172 (CAS 892471-91-9) is a chemical compound with molecular formula C22H22N6O2 and molecular weight 402.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[(4-methylphenyl)methyl]-7-oxotriazolo[4,5-d]pyrimidin-6-yl]-N-(2-phenylethyl)acetamide
Also Known As: F0656-0172, 2-{3-[(4-methylphenyl)methyl]-7-oxo-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}-N-(2-phenylethyl)acetamide, 2-(3-(4-methylbenzyl)-7-oxo-3H-[1,2,3]triazolo[4,5-d]pyrimidin-6(7H)-yl)-N-phenethylacetamide, 2-[3-[(4-methylphenyl)methyl]-7-oxotriazolo[4,5-d]pyrimidin-6-yl]-N-phenethylacetamide, 2-[3-[(4-methylphenyl)methyl]-7-oxotriazolo[4,5-d]pyrimidin-6-yl]-N-(2-phenylethyl)acetamide
| Molecular Formula | C22H22N6O2 |
|---|---|
| Molecular Weight | 402.18 g/mol |
| LogP | 1.70362 |
| Topological Polar Surface Area | 94.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 402.18042 |
| Heavy Atoms | 30 |
| Complexity | 1212.1005 |
Chemical Identifiers
| CAS Number | 892471-91-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C3=C(C(=O)N(C=N3)CC(=O)NCCC4=CC=CC=C4)N=N2 |
Product Overview
F0656-0172 (CAS 892471-91-9), with molecular formula C22H22N6O2 and molecular weight 402.18 g/mol. IUPAC: 2-[3-[(4-methylphenyl)methyl]-7-oxotriazolo[4,5-d]pyrimidin-6-yl]-N-(2-phenylethyl)acetamide.
Chemical Property Profile of F0656-0172
Property Insights of F0656-0172
The XLogP value of 1.70362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0656-0172. The TPSA of 94.7 Ų falls within the moderate polarity range, balancing permeability and solubility for F0656-0172. Following Lipinski's Rule of Five, F0656-0172 has 1 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 F0656-0172?
The CAS number of F0656-0172 is 892471-91-9.
What is the molecular formula of F0656-0172?
The molecular formula of F0656-0172 is C22H22N6O2.
What is the molecular weight of F0656-0172?
The molecular weight of F0656-0172 is 402.18 g/mol.
Where can I buy F0656-0172?
You can request a quote for F0656-0172 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0656-0172?
Yes, KEHONG BIO provides custom synthesis services for F0656-0172 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.