F2514-0098
TL;DR: F2514-0098 (CAS 895012-47-2) is a chemical compound with molecular formula C20H15F3N4O and molecular weight 384.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methylphenyl)-5-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-d]pyrimidin-4-one
Also Known As: F2514-0098, 1-(2-methylphenyl)-5-{[3-(trifluoromethyl)phenyl]methyl}-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one, 1-(2-methylphenyl)-5-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-d]pyrimidin-4-one, 1-(o-tolyl)-5-(3-(trifluoromethyl)benzyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one
| Molecular Formula | C20H15F3N4O |
|---|---|
| Molecular Weight | 384.12 g/mol |
| LogP | 3.95772 |
| Topological Polar Surface Area | 52.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.11978 |
| Heavy Atoms | 28 |
| Complexity | 1224.0736 |
Chemical Identifiers
| CAS Number | 895012-47-2 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C3=C(C=N2)C(=O)N(C=N3)CC4=CC(=CC=C4)C(F)(F)F |
Product Overview
F2514-0098 (CAS 895012-47-2), with molecular formula C20H15F3N4O and molecular weight 384.12 g/mol. IUPAC: 1-(2-methylphenyl)-5-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-d]pyrimidin-4-one.
Chemical Property Profile of F2514-0098
Property Insights of F2514-0098
The XLogP value of 3.95772 indicates that F2514-0098 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.71 Ų, F2514-0098 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F2514-0098 has 0 hydrogen bond donor(s) and 3 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 F2514-0098?
The CAS number of F2514-0098 is 895012-47-2.
What is the molecular formula of F2514-0098?
The molecular formula of F2514-0098 is C20H15F3N4O.
What is the molecular weight of F2514-0098?
The molecular weight of F2514-0098 is 384.12 g/mol.
Where can I buy F2514-0098?
You can request a quote for F2514-0098 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2514-0098?
Yes, KEHONG BIO provides custom synthesis services for F2514-0098 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.