2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline
TL;DR: 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline (CAS 52831-37-5) is a chemical compound with molecular formula C20H18FNOS and molecular weight 339.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzylsulfanyl-3-fluoro-8-methyl-8,9-dihydro-3H-pyrano[3,4-b]quinoline
Also Known As: 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline, 6H-(1)Benzothiopyrano(4,3-b)quinoline, 2-fluoro-7-methyl-, 6H-[1]Benzothiopyrano[4,3-b]quinoline, 2-fluoro-7-methyl-, 4-benzylsulfanyl-3-fluoro-8-methyl-8,9-dihydro-3H-pyrano[3,4-b]quinoline, 4-(Benzylsulfanyl)-3-fluoro-8-methyl-8,9-dihydro-3H-pyrano[3,4-b]quinoline
| Molecular Formula | C20H18FNOS |
|---|---|
| Molecular Weight | 339.11 g/mol |
| LogP | 3.3924 |
| Topological Polar Surface Area | 22.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.1093 |
| Heavy Atoms | 24 |
| Complexity | 907.2264 |
Chemical Identifiers
| CAS Number | 52831-37-5 |
|---|---|
| SMILES | CC1CC2=NC3=COC(C(=C3C=C2C=C1)SCC4=CC=CC=C4)F |
Product Overview
2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline (CAS 52831-37-5), with molecular formula C20H18FNOS and molecular weight 339.11 g/mol. IUPAC: 4-benzylsulfanyl-3-fluoro-8-methyl-8,9-dihydro-3H-pyrano[3,4-b]quinoline.
Chemical Property Profile of 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline
Property Insights of 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline
The XLogP value of 3.3924 indicates that 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.12 Ų, 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline 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 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline?
The CAS number of 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline is 52831-37-5.
What is the molecular formula of 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline?
The molecular formula of 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline is C20H18FNOS.
What is the molecular weight of 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline?
The molecular weight of 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline is 339.11 g/mol.
Where can I buy 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline?
You can request a quote for 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline?
Yes, KEHONG BIO provides custom synthesis services for 2-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.