5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one
TL;DR: 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one (CAS 369605-57-2) is a chemical compound with molecular formula C18H20N2OS and molecular weight 312.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one
Also Known As: 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one, 3-ALLYL-5,5-DIMETHYL-2-(METHYLSULFANYL)-5,6-DIHYDROBENZO[H]QUINAZOLIN-4(3H)-ONE, 3-allyl-5,5-dimethyl-2-(methylthio)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one, 5,5-dimethyl-2-(methylsulfanyl)-3-(prop-2-en-1-yl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
| Molecular Formula | C18H20N2OS |
|---|---|
| Molecular Weight | 312.13 g/mol |
| LogP | 3.6519 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.12964 |
| Heavy Atoms | 22 |
| Complexity | 805.21985 |
Chemical Identifiers
| CAS Number | 369605-57-2 |
|---|---|
| SMILES | CC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SC)CC=C)C |
Product Overview
5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one (CAS 369605-57-2), with molecular formula C18H20N2OS and molecular weight 312.13 g/mol. IUPAC: 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one.
Chemical Property Profile of 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one
Property Insights of 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one
The XLogP value of 3.6519 indicates that 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one 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 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one?
The CAS number of 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one is 369605-57-2.
What is the molecular formula of 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one?
The molecular formula of 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one is C18H20N2OS.
What is the molecular weight of 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one?
The molecular weight of 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one is 312.13 g/mol.
Where can I buy 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one?
You can request a quote for 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]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 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5,5-dimethyl-2-methylsulfanyl-3-prop-2-enyl-6H-benzo[h]quinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.