F2014-0498
TL;DR: F2014-0498 (CAS 877654-38-1) is a chemical compound with molecular formula C15H12F3N3O3S2 and molecular weight 403.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-oxo-3-[4-(trifluoromethoxy)phenyl]-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide
Also Known As: F2014-0498, 2-((4-oxo-3-(4-(trifluoromethoxy)phenyl)-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)acetamide, 2-({4-oxo-3-[4-(trifluoromethoxy)phenyl]-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl}sulfanyl)acetamide, 2-[[4-oxo-3-[4-(trifluoromethoxy)phenyl]-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide
| Molecular Formula | C15H12F3N3O3S2 |
|---|---|
| Molecular Weight | 403.03 g/mol |
| LogP | 2.3567 |
| Topological Polar Surface Area | 87.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.02722 |
| Heavy Atoms | 26 |
| Complexity | 897.98035 |
Chemical Identifiers
| CAS Number | 877654-38-1 |
|---|---|
| SMILES | C1CSC2=C1N=C(N(C2=O)C3=CC=C(C=C3)OC(F)(F)F)SCC(=O)N |
Product Overview
F2014-0498 (CAS 877654-38-1), with molecular formula C15H12F3N3O3S2 and molecular weight 403.03 g/mol. IUPAC: 2-[[4-oxo-3-[4-(trifluoromethoxy)phenyl]-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide.
Chemical Property Profile of F2014-0498
Property Insights of F2014-0498
The XLogP value of 2.3567 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2014-0498. The TPSA of 87.21 Ų falls within the moderate polarity range, balancing permeability and solubility for F2014-0498. Following Lipinski's Rule of Five, F2014-0498 has 1 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 F2014-0498?
The CAS number of F2014-0498 is 877654-38-1.
What is the molecular formula of F2014-0498?
The molecular formula of F2014-0498 is C15H12F3N3O3S2.
What is the molecular weight of F2014-0498?
The molecular weight of F2014-0498 is 403.03 g/mol.
Where can I buy F2014-0498?
You can request a quote for F2014-0498 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2014-0498?
Yes, KEHONG BIO provides custom synthesis services for F2014-0498 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.