Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride
TL;DR: Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride (CAS 5164-37-4) is a chemical compound with molecular formula C12H16ClN and molecular weight 209.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-5-azatricyclo[6.3.1.04,12]dodeca-1(12),8,10-triene;hydrochloride
Also Known As: 1-Aza-1-methyl-1,2,3,7,8,8a-hexahydroacenaphthylene hydrochloride, 1,2,3,7,8,8a-Hexahydro-1-methyl-cyclopent(ij)isoquinoline hydrochloride, 1-methyl-1,2,3,7,8,8a-hexahydrocyclopenta[ij]isoquinoline hydrochloride(1:1), Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride, 1-Methyl-1,2,3,7,8,8a-hexahydrocyclopenta[ij]isoquinoline--hydrogen chloride (1/1)
| Molecular Formula | C12H16ClN |
|---|---|
| Molecular Weight | 209.10 g/mol |
| LogP | 2.5836 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.09712 |
| Heavy Atoms | 14 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 5164-37-4 |
|---|---|
| SMILES | CN1CCC2=CC=CC3=C2C1CC3.Cl |
| InChIKey | PSLFBDOCIBZGRS-UHFFFAOYSA-N |
Product Overview
Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride (CAS 5164-37-4), with molecular formula C12H16ClN and molecular weight 209.10 g/mol. IUPAC: 5-methyl-5-azatricyclo[6.3.1.04,12]dodeca-1(12),8,10-triene;hydrochloride.
Chemical Property Profile of Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride
Property Insights of Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride
The XLogP value of 2.5836 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride. With a topological polar surface area (TPSA) of 3.2 Ų, Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride has 1 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 Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride?
The CAS number of Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride is 5164-37-4.
What is the molecular formula of Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride?
The molecular formula of Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride is C12H16ClN.
What is the molecular weight of Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride?
The molecular weight of Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride is 209.10 g/mol.
Where can I buy Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride?
You can request a quote for Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Cyclopent(ij)isoquinoline, 1,2,3,7,8,8a-hexahydro-1-methyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.