2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one
TL;DR: 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one (CAS 303177-22-2) is a chemical compound with molecular formula C22H24N2O2S and molecular weight 380.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one
Also Known As: BAS 00718709, 2-benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one, AB00094903-01, AJ-292/11720091, 2-(benzylsulfanyl)-3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4(3H)-quinazolinone
| Molecular Formula | C22H24N2O2S |
|---|---|
| Molecular Weight | 380.16 g/mol |
| LogP | 4.8189 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.15585 |
| Heavy Atoms | 27 |
| Complexity | 998.1155 |
Chemical Identifiers
| CAS Number | 303177-22-2 |
|---|---|
| SMILES | CC1(CC(CCO1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4)C |
Product Overview
2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one (CAS 303177-22-2), with molecular formula C22H24N2O2S and molecular weight 380.16 g/mol. IUPAC: 2-benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one.
Chemical Property Profile of 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one
Property Insights of 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one
The XLogP value of 4.8189 indicates that 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one has 0 hydrogen bond donor(s) and 4 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 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one?
The CAS number of 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one is 303177-22-2.
What is the molecular formula of 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one?
The molecular formula of 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one is C22H24N2O2S.
What is the molecular weight of 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one?
The molecular weight of 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one is 380.16 g/mol.
Where can I buy 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one?
You can request a quote for 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzylsulfanyl-3-(2,2-dimethyloxan-4-yl)quinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.