5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride
TL;DR: 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride (CAS 63080-44-4) is a chemical compound with molecular formula C18H26ClNO2 and molecular weight 323.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dimethoxyspiro[1,2,3,8,9,9a-hexahydrobenzo[de]quinoline-7,1'-cyclopentane];hydrochloride
Also Known As: 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride, Spiro(7H-benzo(de)quinoline-7,1'-cyclopentane), 1,2,3,8,9,9a-hexahydro-5,6-dimethoxy-, hydrochloride, 5,6-Dimethoxy-1,2,3,8,9,9a-hexahydrospiro[benzo[de]quinoline-7,1'-cyclopentane]--hydrogen chloride (1/1), 5,6-dimethoxyspiro[1,2,3,8,9,9a-hexahydrobenzo[de]quinoline-7,1'-cyclopentane] hydrochloride, RefChem:380934
| Molecular Formula | C18H26ClNO2 |
|---|---|
| Molecular Weight | 323.17 g/mol |
| LogP | 3.918 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 323.1652 |
| Heavy Atoms | 22 |
| Complexity | 566.69586 |
Chemical Identifiers
| CAS Number | 63080-44-4 |
|---|---|
| SMILES | COC1=C(C2=C3C(CCC24CCCC4)NCCC3=C1)OC.Cl |
Product Overview
5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride (CAS 63080-44-4), with molecular formula C18H26ClNO2 and molecular weight 323.17 g/mol. IUPAC: 5,6-dimethoxyspiro[1,2,3,8,9,9a-hexahydrobenzo[de]quinoline-7,1'-cyclopentane];hydrochloride.
Chemical Property Profile of 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride
Property Insights of 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride
The XLogP value of 3.918 indicates that 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.49 Ų, 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride has 1 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 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride?
The CAS number of 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride is 63080-44-4.
What is the molecular formula of 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride?
The molecular formula of 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride is C18H26ClNO2.
What is the molecular weight of 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride?
The molecular weight of 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride is 323.17 g/mol.
Where can I buy 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride?
You can request a quote for 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dimethoxy-2,3,7,8,9,9a-hexahydrospiro(1H-benzo(de)chinolin-7,1'-cyclopentan)-hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.