6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)-
TL;DR: 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)- (CAS 52833-86-0) is a chemical compound with molecular formula C20H16F3NOS and molecular weight 375.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzylsulfanyl-4-(trifluoromethyl)-6,7-dihydro-3H-pyrano[4,3-b]quinoline
Also Known As: 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)-, 4-(Trifluoromethyl)-6H-(1)benzothiopyrano(4,3-b)quinoline, 6H-[1]Benzothiopyrano[4,3-b]quinoline, 4-(trifluoromethyl)-, 1-benzylsulfanyl-4-(trifluoromethyl)-6,7-dihydro-3H-pyrano[4,3-b]quinoline, 1-(Benzylsulfanyl)-4-(trifluoromethyl)-6,7-dihydro-3H-pyrano[4,3-b]quinoline
| Molecular Formula | C20H16F3NOS |
|---|---|
| Molecular Weight | 375.09 g/mol |
| LogP | 3.7833 |
| Topological Polar Surface Area | 22.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.09048 |
| Heavy Atoms | 26 |
| Complexity | 980.5964 |
Chemical Identifiers
| CAS Number | 52833-86-0 |
|---|---|
| SMILES | C1CC2=NC3=C(COC(=C3C=C2C=C1)SCC4=CC=CC=C4)C(F)(F)F |
Product Overview
6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)- (CAS 52833-86-0), with molecular formula C20H16F3NOS and molecular weight 375.09 g/mol. IUPAC: 1-benzylsulfanyl-4-(trifluoromethyl)-6,7-dihydro-3H-pyrano[4,3-b]quinoline.
Chemical Property Profile of 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)-
Property Insights of 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)-
The XLogP value of 3.7833 indicates that 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.12 Ų, 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)- 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 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)-?
The CAS number of 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)- is 52833-86-0.
What is the molecular formula of 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)-?
The molecular formula of 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)- is C20H16F3NOS.
What is the molecular weight of 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)-?
The molecular weight of 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)- is 375.09 g/mol.
Where can I buy 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)-?
You can request a quote for 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 6H-(1)Benzothiopyrano(4,3-b)quinoline, 4-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.