Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate
TL;DR: Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate (CAS 740837-79-0) is a chemical compound with molecular formula C19H17ClN2O3S and molecular weight 388.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetate
Also Known As: Isopropyl 2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetate, propan-2-yl 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate, ISOPROPYL ((3-(4-CHLOROPHENYL)-4-OXO-3,4-DIHYDRO-2-QUINAZOLINYL)THIO)ACETATE, propan-2-yl 2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetate, propan-2-yl {[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate
| Molecular Formula | C19H17ClN2O3S |
|---|---|
| Molecular Weight | 388.06 g/mol |
| LogP | 4.0828 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.06485 |
| Heavy Atoms | 26 |
| Complexity | 999.83203 |
Chemical Identifiers
| CAS Number | 740837-79-0 |
|---|---|
| SMILES | CC(C)OC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Cl |
Product Overview
Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate (CAS 740837-79-0), with molecular formula C19H17ClN2O3S and molecular weight 388.06 g/mol. IUPAC: propan-2-yl 2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetate.
Chemical Property Profile of Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate
Property Insights of Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate
The XLogP value of 4.0828 indicates that Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate 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 Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate. Following Lipinski's Rule of Five, Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate 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 Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate?
The CAS number of Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate is 740837-79-0.
What is the molecular formula of Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate?
The molecular formula of Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate is C19H17ClN2O3S.
What is the molecular weight of Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate?
The molecular weight of Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate is 388.06 g/mol.
Where can I buy Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate?
You can request a quote for Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl ((3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.