Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate
TL;DR: Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate (CAS 385392-15-4) is a chemical compound with molecular formula C20H20N2O3S and molecular weight 368.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate
Also Known As: ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate, ethyl 2-((3-benzyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)propanoate, ethyl 2-[(3-benzyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]propanoate
| Molecular Formula | C20H20N2O3S |
|---|---|
| Molecular Weight | 368.12 g/mol |
| LogP | 3.4885 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 368.11948 |
| Heavy Atoms | 26 |
| Complexity | 969.7023 |
Chemical Identifiers
| CAS Number | 385392-15-4 |
|---|---|
| SMILES | CCOC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3 |
Product Overview
Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate (CAS 385392-15-4), with molecular formula C20H20N2O3S and molecular weight 368.12 g/mol. IUPAC: ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate.
Chemical Property Profile of Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate
Property Insights of Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate
The XLogP value of 3.4885 indicates that Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate 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 Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate. Following Lipinski's Rule of Five, Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate has 0 hydrogen bond donor(s) and 5 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 Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate?
The CAS number of Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate is 385392-15-4.
What is the molecular formula of Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate?
The molecular formula of Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate is C20H20N2O3S.
What is the molecular weight of Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate?
The molecular weight of Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate is 368.12 g/mol.
Where can I buy Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate?
You can request a quote for Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.