必利停錠
TL;DR: 必利停錠 (CAS 202189-78-4) is a chemical compound with molecular formula C14H16ClNO and molecular weight 249.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
必利停錠
(4aS,10bS)-8-chloro-4-methyl-1,2,4a,5,6,10b-hexahydrobenzo[f]quinolin-3-one
Also Known As: Bexlosteride, LY 191704, HY-118091B, 8-Chloro-4-methyl-1,2,3,4,4a,5,6,10b-octahydrobenzo(f)quinolin-3(2H)-one, (4aS,10bS)-8-chloro-4-methyl-1,2,4a,5,6,10b-hexahydrobenzo[f]quinolin-3-one
| Molecular Formula | C14H16ClNO |
|---|---|
| Molecular Weight | 249.09 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 249.09204 |
| Heavy Atoms | 17 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 202189-78-4 |
|---|---|
| SMILES | CN1[C@H]2CCC3=C([C@@H]2CCC1=O)C=CC(=C3)Cl |
| InChIKey | WQBIOEFDDDEARX-STQMWFEESA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
必利停錠 (CAS 202189-78-4), with molecular formula C14H16ClNO and molecular weight 249.09 g/mol. IUPAC: (4aS,10bS)-8-chloro-4-methyl-1,2,4a,5,6,10b-hexahydrobenzo[f]quinolin-3-one.
Chemical Property Profile of 必利停錠
Property Insights of 必利停錠
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 必利停錠. With a topological polar surface area (TPSA) of 20.3 Ų, 必利停錠 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 必利停錠 has 0 hydrogen bond donor(s) and 1 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 必利停錠?
The CAS number of 必利停錠 is 202189-78-4.
What is the molecular formula of 必利停錠?
The molecular formula of 必利停錠 is C14H16ClNO.
What is the molecular weight of 必利停錠?
The molecular weight of 必利停錠 is 249.09 g/mol.
Where can I buy 必利停錠?
You can request a quote for 必利停錠 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 必利停錠?
Yes, KEHONG BIO provides custom synthesis services for 必利停錠 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.