VU0495697-1
TL;DR: VU0495697-1 (CAS 899954-05-3) is a chemical compound with molecular formula C15H13F3N4O2 and molecular weight 338.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-hydroxyethyl)-5-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-d]pyrimidin-4-one
Also Known As: VU0495697-1, F2746-0145, 1-(2-hydroxyethyl)-5-{[4-(trifluoromethyl)phenyl]methyl}-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one, 1-(2-hydroxyethyl)-5-(4-(trifluoromethyl)benzyl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one, 1-(2-hydroxyethyl)-5-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-d]pyrimidin-4-one
| Molecular Formula | C15H13F3N4O2 |
|---|---|
| Molecular Weight | 338.10 g/mol |
| LogP | 1.6524 |
| Topological Polar Surface Area | 72.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.09906 |
| Heavy Atoms | 24 |
| Complexity | 913.09924 |
Chemical Identifiers
| CAS Number | 899954-05-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C=NC3=C(C2=O)C=NN3CCO)C(F)(F)F |
Product Overview
VU0495697-1 (CAS 899954-05-3), with molecular formula C15H13F3N4O2 and molecular weight 338.10 g/mol. IUPAC: 1-(2-hydroxyethyl)-5-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-d]pyrimidin-4-one.
Chemical Property Profile of VU0495697-1
Property Insights of VU0495697-1
The XLogP value of 1.6524 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0495697-1. The TPSA of 72.94 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0495697-1. Following Lipinski's Rule of Five, VU0495697-1 has 1 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 VU0495697-1?
The CAS number of VU0495697-1 is 899954-05-3.
What is the molecular formula of VU0495697-1?
The molecular formula of VU0495697-1 is C15H13F3N4O2.
What is the molecular weight of VU0495697-1?
The molecular weight of VU0495697-1 is 338.10 g/mol.
Where can I buy VU0495697-1?
You can request a quote for VU0495697-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0495697-1?
Yes, KEHONG BIO provides custom synthesis services for VU0495697-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.