![4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline structure](/static/products/893/893787-34-3.png)
4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline
TL;DR: 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline (CAS 893787-34-3) is a chemical compound with molecular formula C17H17ClN2S and molecular weight 316.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline
Also Known As: E971-0078, 4-((4-chlorobenzyl)thio)-2,2-dimethyl-1,2-dihydroquinazoline, 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline, F3165-0943, 4-{[(4-chlorophenyl)methyl]sulfanyl}-2,2-dimethyl-1,2-dihydroquinazoline
| Molecular Formula | C17H17ClN2S |
|---|---|
| Molecular Weight | 316.08 g/mol |
| LogP | 5.1816 |
| Topological Polar Surface Area | 24.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 316.0801 |
| Heavy Atoms | 21 |
| Complexity | 677.4444 |
Chemical Identifiers
| CAS Number | 893787-34-3 |
|---|---|
| SMILES | CC1(NC2=CC=CC=C2C(=N1)SCC3=CC=C(C=C3)Cl)C |
Product Overview
4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline (CAS 893787-34-3), with molecular formula C17H17ClN2S and molecular weight 316.08 g/mol. IUPAC: 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline.
Chemical Property Profile of 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline
Property Insights of 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline
The XLogP value of 5.1816 indicates that 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.39 Ų, 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline?
The CAS number of 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline is 893787-34-3.
What is the molecular formula of 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline?
The molecular formula of 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline is C17H17ClN2S.
What is the molecular weight of 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline?
The molecular weight of 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline is 316.08 g/mol.
Where can I buy 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline?
You can request a quote for 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-chlorophenyl)methylsulfanyl]-2,2-dimethyl-1H-quinazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.