VU0493915-1
TL;DR: VU0493915-1 (CAS 686771-85-7) is a chemical compound with molecular formula C19H22N2O3S2 and molecular weight 390.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methyl-2-[[3-(4-methylphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]propanoate
Also Known As: VU0493915-1, F0579-0181, ethyl 2-methyl-2-((4-oxo-3-(p-tolyl)-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)propanoate, ethyl 2-methyl-2-{[3-(4-methylphenyl)-4-oxo-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}propanoate, ethyl 2-methyl-2-[[3-(4-methylphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]propanoate
| Molecular Formula | C19H22N2O3S2 |
|---|---|
| Molecular Weight | 390.11 g/mol |
| LogP | 3.62292 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.10718 |
| Heavy Atoms | 26 |
| Complexity | 888.89264 |
Chemical Identifiers
| CAS Number | 686771-85-7 |
|---|---|
| SMILES | CCOC(=O)C(C)(C)SC1=NC2=C(C(=O)N1C3=CC=C(C=C3)C)SCC2 |
Product Overview
VU0493915-1 (CAS 686771-85-7), with molecular formula C19H22N2O3S2 and molecular weight 390.11 g/mol. IUPAC: ethyl 2-methyl-2-[[3-(4-methylphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]propanoate.
Chemical Property Profile of VU0493915-1
Property Insights of VU0493915-1
The XLogP value of 3.62292 indicates that VU0493915-1 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 VU0493915-1. Following Lipinski's Rule of Five, VU0493915-1 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 VU0493915-1?
The CAS number of VU0493915-1 is 686771-85-7.
What is the molecular formula of VU0493915-1?
The molecular formula of VU0493915-1 is C19H22N2O3S2.
What is the molecular weight of VU0493915-1?
The molecular weight of VU0493915-1 is 390.11 g/mol.
Where can I buy VU0493915-1?
You can request a quote for VU0493915-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0493915-1?
Yes, KEHONG BIO provides custom synthesis services for VU0493915-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.