F1876-0511
TL;DR: F1876-0511 (CAS 872590-95-9) is a chemical compound with molecular formula C17H11F3N6O2 and molecular weight 388.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(pyridin-2-ylmethyl)-3-[4-(trifluoromethoxy)phenyl]triazolo[4,5-d]pyrimidin-7-one
Also Known As: F1876-0511, 6-[(pyridin-2-yl)methyl]-3-[4-(trifluoromethoxy)phenyl]-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one, 6-(pyridin-2-ylmethyl)-3-[4-(trifluoromethoxy)phenyl]triazolo[4,5-d]pyrimidin-7-one, 6-(pyridin-2-ylmethyl)-3-(4-(trifluoromethoxy)phenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7(6H)-one
| Molecular Formula | C17H11F3N6O2 |
|---|---|
| Molecular Weight | 388.09 g/mol |
| LogP | 2.3191 |
| Topological Polar Surface Area | 87.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.08957 |
| Heavy Atoms | 28 |
| Complexity | 1169.6901 |
Chemical Identifiers
| CAS Number | 872590-95-9 |
|---|---|
| SMILES | C1=CC=NC(=C1)CN2C=NC3=C(C2=O)N=NN3C4=CC=C(C=C4)OC(F)(F)F |
Product Overview
F1876-0511 (CAS 872590-95-9), with molecular formula C17H11F3N6O2 and molecular weight 388.09 g/mol. IUPAC: 6-(pyridin-2-ylmethyl)-3-[4-(trifluoromethoxy)phenyl]triazolo[4,5-d]pyrimidin-7-one.
Chemical Property Profile of F1876-0511
Property Insights of F1876-0511
The XLogP value of 2.3191 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1876-0511. The TPSA of 87.72 Ų falls within the moderate polarity range, balancing permeability and solubility for F1876-0511. Following Lipinski's Rule of Five, F1876-0511 has 0 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 F1876-0511?
The CAS number of F1876-0511 is 872590-95-9.
What is the molecular formula of F1876-0511?
The molecular formula of F1876-0511 is C17H11F3N6O2.
What is the molecular weight of F1876-0511?
The molecular weight of F1876-0511 is 388.09 g/mol.
Where can I buy F1876-0511?
You can request a quote for F1876-0511 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1876-0511?
Yes, KEHONG BIO provides custom synthesis services for F1876-0511 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.