F0682-0785
TL;DR: F0682-0785 (CAS 863459-74-9) is a chemical compound with molecular formula C16H15FN6OS and molecular weight 358.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4-fluorophenyl)triazolo[4,5-d]pyrimidin-7-yl]sulfanyl-1-pyrrolidin-1-ylethanone
Also Known As: F0682-0785, 2-{[3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethan-1-one, 2-[3-(4-fluorophenyl)triazolo[4,5-d]pyrimidin-7-yl]sulfanyl-1-pyrrolidin-1-ylethanone, 2-((3-(4-fluorophenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)thio)-1-(pyrrolidin-1-yl)ethanone
| Molecular Formula | C16H15FN6OS |
|---|---|
| Molecular Weight | 358.10 g/mol |
| LogP | 2.0641 |
| Topological Polar Surface Area | 76.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.1012 |
| Heavy Atoms | 25 |
| Complexity | 906.63385 |
Chemical Identifiers
| CAS Number | 863459-74-9 |
|---|---|
| SMILES | C1CCN(C1)C(=O)CSC2=NC=NC3=C2N=NN3C4=CC=C(C=C4)F |
Product Overview
F0682-0785 (CAS 863459-74-9), with molecular formula C16H15FN6OS and molecular weight 358.10 g/mol. IUPAC: 2-[3-(4-fluorophenyl)triazolo[4,5-d]pyrimidin-7-yl]sulfanyl-1-pyrrolidin-1-ylethanone.
Chemical Property Profile of F0682-0785
Property Insights of F0682-0785
The XLogP value of 2.0641 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0682-0785. The TPSA of 76.8 Ų falls within the moderate polarity range, balancing permeability and solubility for F0682-0785. Following Lipinski's Rule of Five, F0682-0785 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 F0682-0785?
The CAS number of F0682-0785 is 863459-74-9.
What is the molecular formula of F0682-0785?
The molecular formula of F0682-0785 is C16H15FN6OS.
What is the molecular weight of F0682-0785?
The molecular weight of F0682-0785 is 358.10 g/mol.
Where can I buy F0682-0785?
You can request a quote for F0682-0785 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0682-0785?
Yes, KEHONG BIO provides custom synthesis services for F0682-0785 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.