![6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane] structure](/static/products/3328/332898-97-2.webp)
6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane]
TL;DR: 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane] (CAS 332898-97-2) is a chemical compound with molecular formula C16H21NO2S and molecular weight 291.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane]
Also Known As: BAS 01365860, BIM-0043605.P001, 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane], 6',7'-dimethoxy-1'-(methylsulfanyl)-3',4'-dihydrospiro[cyclopentane-2,3'-isoquinoline], 6',7'-dimethoxy-1'-(methylthio)-4'H-spiro[cyclopentane-1,3'-isoquinoline]
| Molecular Formula | C16H21NO2S |
|---|---|
| Molecular Weight | 291.13 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 56.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 291.1293 |
| Heavy Atoms | 20 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 332898-97-2 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)CC3(CCCC3)N=C2SC)OC |
| InChIKey | BRBRPRUPAFZBRK-UHFFFAOYSA-N |
Product Overview
6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane] (CAS 332898-97-2), with molecular formula C16H21NO2S and molecular weight 291.13 g/mol. IUPAC: 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane].
Chemical Property Profile of 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane]
Property Insights of 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane]
The XLogP value of 3.3 indicates that 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.1 Ų, 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane] has 0 hydrogen bond donor(s) and 4 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 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane]?
The CAS number of 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane] is 332898-97-2.
What is the molecular formula of 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane]?
The molecular formula of 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane] is C16H21NO2S.
What is the molecular weight of 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane]?
The molecular weight of 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane] is 291.13 g/mol.
Where can I buy 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane]?
You can request a quote for 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane]?
Yes, KEHONG BIO provides custom synthesis services for 6,7-dimethoxy-1-methylsulfanylspiro[4H-isoquinoline-3,1'-cyclopentane] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.