2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride
TL;DR: 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride (CAS 15565-23-8) is a chemical compound with molecular formula C21H34ClNO2S2 and molecular weight 431.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9,10-dimethoxy-3-(2-methylpropyl)-2,2-bis(methylsulfanyl)-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizine;hydrochloride
Also Known As: 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride, 2H-Benzo[a]quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-3-(2-methylpropyl)-2,2-bis(methylthio)-, hydrochloride, 9,10-Dimethoxy-3-(2-methylpropyl)-2,2-bis(methylsulfanyl)-1,3,4,6,7,11b-hexahydro-2H-pyrido[2,1-a]isoquinoline--hydrogen chloride (1/1), 9,10-dimethoxy-3-(2-methylpropyl)-2,2-bis(methylsulfanyl)-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizine hydrochloride, RefChem:268583
| Molecular Formula | C21H34ClNO2S2 |
|---|---|
| Molecular Weight | 431.17 g/mol |
| LogP | 5.5131 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.17194 |
| Heavy Atoms | 27 |
| Complexity | 457.0 |
Chemical Identifiers
| CAS Number | 15565-23-8 |
|---|---|
| SMILES | CC(C)CC1CN2CCC3=CC(=C(C=C3C2CC1(SC)SC)OC)OC.Cl |
| InChIKey | HGKZAMAUOLFOPX-UHFFFAOYSA-N |
Product Overview
2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride (CAS 15565-23-8), with molecular formula C21H34ClNO2S2 and molecular weight 431.17 g/mol. IUPAC: 9,10-dimethoxy-3-(2-methylpropyl)-2,2-bis(methylsulfanyl)-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizine;hydrochloride.
Chemical Property Profile of 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride
Property Insights of 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride
The XLogP value of 5.5131 indicates that 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride. Following Lipinski's Rule of Five, 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride?
The CAS number of 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride is 15565-23-8.
What is the molecular formula of 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride?
The molecular formula of 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride is C21H34ClNO2S2.
What is the molecular weight of 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride?
The molecular weight of 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride is 431.17 g/mol.
Where can I buy 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride?
You can request a quote for 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2H-Benzo(a)quinolizine, 1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-2,2-dimethylthio-3-(2-methylpropyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.