RefChem:324302
TL;DR: RefChem:324302 (CAS 102038-02-8) is a chemical compound with molecular formula C19H18N2O3S and molecular weight 354.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-(2-methylsulfanyl-4-oxoquinazolin-3-yl)phenyl]propanoate
Also Known As: Methyl 4-(2-methylthio-4(3H)-quinazolon-3-yl)phenylpropionate, Methyl alpha-methyl-4-(2-(methylthio)-4-oxo-3(4H)-quinazolinyl)benzeneacetate, Benzeneacetic acid, alpha-methyl-4-(2-(methylthio)-4-oxo-3(4H)-quinazolinyl)-, methyl ester, methyl 2-[4-(2-methylsulfanyl-4-oxoquinazolin-3-yl)phenyl]propanoate, Methyl 2-{4-[2-(methylsulfanyl)-4-oxoquinazolin-3(4H)-yl]phenyl}propanoate
| Molecular Formula | C19H18N2O3S |
|---|---|
| Molecular Weight | 354.10 g/mol |
| LogP | 3.3841 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.10382 |
| Heavy Atoms | 25 |
| Complexity | 980.1209 |
Chemical Identifiers
| CAS Number | 102038-02-8 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC)C(=O)OC |
Product Overview
RefChem:324302 (CAS 102038-02-8), with molecular formula C19H18N2O3S and molecular weight 354.10 g/mol. IUPAC: methyl 2-[4-(2-methylsulfanyl-4-oxoquinazolin-3-yl)phenyl]propanoate.
Chemical Property Profile of RefChem:324302
Property Insights of RefChem:324302
The XLogP value of 3.3841 indicates that RefChem:324302 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 RefChem:324302. Following Lipinski's Rule of Five, RefChem:324302 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 RefChem:324302?
The CAS number of RefChem:324302 is 102038-02-8.
What is the molecular formula of RefChem:324302?
The molecular formula of RefChem:324302 is C19H18N2O3S.
What is the molecular weight of RefChem:324302?
The molecular weight of RefChem:324302 is 354.10 g/mol.
Where can I buy RefChem:324302?
You can request a quote for RefChem:324302 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:324302?
Yes, KEHONG BIO provides custom synthesis services for RefChem:324302 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.