Benzyl 2-quinazolin-4-ylsulfanylacetate
TL;DR: Benzyl 2-quinazolin-4-ylsulfanylacetate (CAS 852367-02-3) is a chemical compound with molecular formula C17H14N2O2S and molecular weight 310.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-quinazolin-4-ylsulfanylacetate
Also Known As: ChemDiv2_007067, benzyl (4-quinazolinylthio)acetate, benzyl 2-(quinazolin-4-ylthio)acetate, benzyl 2-(quinazolin-4-ylsulfanyl)acetate, benzyl 2-quinazolin-4-ylsulfanylacetate
| Molecular Formula | C17H14N2O2S |
|---|---|
| Molecular Weight | 310.08 g/mol |
| LogP | 3.4653 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.0776 |
| Heavy Atoms | 22 |
| Complexity | 772.47565 |
Chemical Identifiers
| CAS Number | 852367-02-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)CSC2=NC=NC3=CC=CC=C32 |
Product Overview
Benzyl 2-quinazolin-4-ylsulfanylacetate (CAS 852367-02-3), with molecular formula C17H14N2O2S and molecular weight 310.08 g/mol. IUPAC: benzyl 2-quinazolin-4-ylsulfanylacetate.
Chemical Property Profile of Benzyl 2-quinazolin-4-ylsulfanylacetate
Property Insights of Benzyl 2-quinazolin-4-ylsulfanylacetate
The XLogP value of 3.4653 indicates that Benzyl 2-quinazolin-4-ylsulfanylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.08 Ų, Benzyl 2-quinazolin-4-ylsulfanylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 2-quinazolin-4-ylsulfanylacetate 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 Benzyl 2-quinazolin-4-ylsulfanylacetate?
The CAS number of Benzyl 2-quinazolin-4-ylsulfanylacetate is 852367-02-3.
What is the molecular formula of Benzyl 2-quinazolin-4-ylsulfanylacetate?
The molecular formula of Benzyl 2-quinazolin-4-ylsulfanylacetate is C17H14N2O2S.
What is the molecular weight of Benzyl 2-quinazolin-4-ylsulfanylacetate?
The molecular weight of Benzyl 2-quinazolin-4-ylsulfanylacetate is 310.08 g/mol.
Where can I buy Benzyl 2-quinazolin-4-ylsulfanylacetate?
You can request a quote for Benzyl 2-quinazolin-4-ylsulfanylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 2-quinazolin-4-ylsulfanylacetate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 2-quinazolin-4-ylsulfanylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.