6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline
TL;DR: 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline (CAS 627062-16-2) is a chemical compound with molecular formula C17H11ClN2S and molecular weight 310.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-4-phenyl-2-prop-2-ynylsulfanylquinazoline
Also Known As: 6-chloro-4-phenyl-2-prop-2-ynylsulfanylquinazoline, 6-chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline, 6-chloro-4-phenyl-2-prop-2-ynylthioquinazoline
| Molecular Formula | C17H11ClN2S |
|---|---|
| Molecular Weight | 310.03 g/mol |
| LogP | 4.6755 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.03314 |
| Heavy Atoms | 21 |
| Complexity | 825.308 |
Chemical Identifiers
| CAS Number | 627062-16-2 |
|---|---|
| SMILES | C#CCSC1=NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3 |
Product Overview
6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline (CAS 627062-16-2), with molecular formula C17H11ClN2S and molecular weight 310.03 g/mol. IUPAC: 6-chloro-4-phenyl-2-prop-2-ynylsulfanylquinazoline.
Chemical Property Profile of 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline
Property Insights of 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline
The XLogP value of 4.6755 indicates that 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline has 0 hydrogen bond donor(s) and 3 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 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline?
The CAS number of 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline is 627062-16-2.
What is the molecular formula of 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline?
The molecular formula of 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline is C17H11ClN2S.
What is the molecular weight of 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline?
The molecular weight of 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline is 310.03 g/mol.
Where can I buy 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline?
You can request a quote for 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-4-phenyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.