3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline
TL;DR: 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline (CAS 52831-48-8) is a chemical compound with molecular formula C17H12FNS and molecular weight 281.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-fluoro-7-methyl-6H-thiochromeno[4,3-b]quinoline
Also Known As: 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline, 3-fluoro-7-methyl-6H-thiochromeno[4,3-b]quinoline, 6H-(1)BENZOTHIOPYRANO(4,3-b)QUINOLINE, 3-FLUORO-7-METHYL-, 3-Fluoro-7-methyl-6H-[1]benzothiopyrano[4,3-b]quinoline, 8-FLUORO-12-METHYL-11H-10-THIA-5-AZATETRAPHENE
| Molecular Formula | C17H12FNS |
|---|---|
| Molecular Weight | 281.07 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 38.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 281.06744 |
| Heavy Atoms | 20 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 52831-48-8 |
|---|---|
| SMILES | CC1=C2CSC3=C(C2=NC4=CC=CC=C14)C=CC(=C3)F |
| InChIKey | DTZNMYIUKRSBSC-UHFFFAOYSA-N |
Product Overview
3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline (CAS 52831-48-8), with molecular formula C17H12FNS and molecular weight 281.07 g/mol. IUPAC: 3-fluoro-7-methyl-6H-thiochromeno[4,3-b]quinoline.
Chemical Property Profile of 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline
Property Insights of 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline
The XLogP value of 4.4 indicates that 3-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 38.2 Ų, 3-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, 3-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 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline?
The CAS number of 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline is 52831-48-8.
What is the molecular formula of 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline?
The molecular formula of 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline is C17H12FNS.
What is the molecular weight of 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline?
The molecular weight of 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline is 281.07 g/mol.
Where can I buy 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline?
You can request a quote for 3-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 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline?
Yes, KEHONG BIO provides custom synthesis services for 3-Fluoro-7-methyl-6H-(1)benzothiopyrano(4,3-b)quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.