F0682-1012
TL;DR: F0682-1012 (CAS 941906-16-7) is a chemical compound with molecular formula C17H18N6O3S and molecular weight 386.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(3-methoxyphenyl)triazolo[4,5-d]pyrimidin-7-yl]sulfanyl-1-morpholin-4-ylethanone
Also Known As: F0682-1012, 2-((3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)thio)-1-morpholinoethanone, 2-{[3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one, 2-[3-(3-methoxyphenyl)triazolo[4,5-d]pyrimidin-7-yl]sulfanyl-1-morpholin-4-ylethanone
| Molecular Formula | C17H18N6O3S |
|---|---|
| Molecular Weight | 386.12 g/mol |
| LogP | 1.17 |
| Topological Polar Surface Area | 95.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.11612 |
| Heavy Atoms | 27 |
| Complexity | 956.74664 |
Chemical Identifiers
| CAS Number | 941906-16-7 |
|---|---|
| SMILES | COC1=CC=CC(=C1)N2C3=C(C(=NC=N3)SCC(=O)N4CCOCC4)N=N2 |
Product Overview
F0682-1012 (CAS 941906-16-7), with molecular formula C17H18N6O3S and molecular weight 386.12 g/mol. IUPAC: 2-[3-(3-methoxyphenyl)triazolo[4,5-d]pyrimidin-7-yl]sulfanyl-1-morpholin-4-ylethanone.
Chemical Property Profile of F0682-1012
Property Insights of F0682-1012
The XLogP value of 1.17 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0682-1012. The TPSA of 95.26 Ų falls within the moderate polarity range, balancing permeability and solubility for F0682-1012. Following Lipinski's Rule of Five, F0682-1012 has 0 hydrogen bond donor(s) and 8 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 F0682-1012?
The CAS number of F0682-1012 is 941906-16-7.
What is the molecular formula of F0682-1012?
The molecular formula of F0682-1012 is C17H18N6O3S.
What is the molecular weight of F0682-1012?
The molecular weight of F0682-1012 is 386.12 g/mol.
Where can I buy F0682-1012?
You can request a quote for F0682-1012 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0682-1012?
Yes, KEHONG BIO provides custom synthesis services for F0682-1012 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.