F0579-0182
TL;DR: F0579-0182 (CAS 686771-86-8) is a chemical compound with molecular formula C18H20N2O3S2 and molecular weight 376.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[3-(4-methylphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]butanoate
Also Known As: F0579-0182, methyl 2-((4-oxo-3-(p-tolyl)-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)butanoate, methyl 2-{[3-(4-methylphenyl)-4-oxo-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}butanoate, methyl 2-[[3-(4-methylphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]butanoate
| Molecular Formula | C18H20N2O3S2 |
|---|---|
| Molecular Weight | 376.09 g/mol |
| LogP | 3.23282 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.09152 |
| Heavy Atoms | 25 |
| Complexity | 846.6351 |
Chemical Identifiers
| CAS Number | 686771-86-8 |
|---|---|
| SMILES | CCC(C(=O)OC)SC1=NC2=C(C(=O)N1C3=CC=C(C=C3)C)SCC2 |
Product Overview
F0579-0182 (CAS 686771-86-8), with molecular formula C18H20N2O3S2 and molecular weight 376.09 g/mol. IUPAC: methyl 2-[[3-(4-methylphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]butanoate.
Chemical Property Profile of F0579-0182
Property Insights of F0579-0182
The XLogP value of 3.23282 indicates that F0579-0182 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for F0579-0182. Following Lipinski's Rule of Five, F0579-0182 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 F0579-0182?
The CAS number of F0579-0182 is 686771-86-8.
What is the molecular formula of F0579-0182?
The molecular formula of F0579-0182 is C18H20N2O3S2.
What is the molecular weight of F0579-0182?
The molecular weight of F0579-0182 is 376.09 g/mol.
Where can I buy F0579-0182?
You can request a quote for F0579-0182 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0579-0182?
Yes, KEHONG BIO provides custom synthesis services for F0579-0182 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.