4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline
TL;DR: 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline (CAS 667404-20-8) is a chemical compound with molecular formula C14H14N2S and molecular weight 242.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6,7-trimethyl-2-prop-2-ynylsulfanylquinazoline
Also Known As: 4,6,7-trimethyl-2-prop-2-ynylthioquinazoline, 4,6,7-trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline, 4,6,7-trimethyl-2-prop-2-ynylsulfanylquinazoline, 4,6,7-trimethyl-2-(prop-2-yn-1-ylthio)quinazoline
| Molecular Formula | C14H14N2S |
|---|---|
| Molecular Weight | 242.09 g/mol |
| LogP | 3.28036 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.08777 |
| Heavy Atoms | 17 |
| Complexity | 611.6288 |
Chemical Identifiers
| CAS Number | 667404-20-8 |
|---|---|
| SMILES | CC1=CC2=C(N=C(N=C2C=C1C)SCC#C)C |
Product Overview
4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline (CAS 667404-20-8), with molecular formula C14H14N2S and molecular weight 242.09 g/mol. IUPAC: 4,6,7-trimethyl-2-prop-2-ynylsulfanylquinazoline.
Chemical Property Profile of 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline
Property Insights of 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline
The XLogP value of 3.28036 indicates that 4,6,7-Trimethyl-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, 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6,7-Trimethyl-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 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline?
The CAS number of 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline is 667404-20-8.
What is the molecular formula of 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline?
The molecular formula of 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline is C14H14N2S.
What is the molecular weight of 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline?
The molecular weight of 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline is 242.09 g/mol.
Where can I buy 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline?
You can request a quote for 4,6,7-Trimethyl-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 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline?
Yes, KEHONG BIO provides custom synthesis services for 4,6,7-Trimethyl-2-(prop-2-yn-1-ylsulfanyl)quinazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.