6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride
TL;DR: 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride (CAS 67877-79-6) is a chemical compound with molecular formula C18H22N2O and molecular weight 282.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2-prop-2-enyl-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10,12,14-tetraen-2-ol
Also Known As: 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride, 2,3,3a,4,5,6-Hexahydro-3-methyl-6-(2-propenyl)-1H-indolo(3,2,1-de)(1,5)naphthyridin-6-ol, 1H-Indolo(3,2,1-de)(1,5)naphthyridin-6-ol, 2,3,3a,4,5,6-hexahydro-3-methyl-6-(2-propenyl)-, 3-Methyl-6-(prop-2-en-1-yl)-2,3,3a,4,5,6-hexahydro-1H-indolo[3,2,1-de][1,5]naphthyridin-6-ol, RefChem:239186
| Molecular Formula | C18H22N2O |
|---|---|
| Molecular Weight | 282.17 g/mol |
| LogP | 3.1853 |
| Topological Polar Surface Area | 28.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.17322 |
| Heavy Atoms | 21 |
| Complexity | 717.3218 |
Chemical Identifiers
| CAS Number | 67877-79-6 |
|---|---|
| SMILES | CN1CCC2=C3C1CCC(N3C4=CC=CC=C24)(CC=C)O |
Product Overview
6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride (CAS 67877-79-6), with molecular formula C18H22N2O and molecular weight 282.17 g/mol. IUPAC: 6-methyl-2-prop-2-enyl-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10,12,14-tetraen-2-ol.
Chemical Property Profile of 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride
Property Insights of 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride
The XLogP value of 3.1853 indicates that 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.4 Ų, 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride has 1 hydrogen bond donor(s) and 2 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-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride?
The CAS number of 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride is 67877-79-6.
What is the molecular formula of 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride?
The molecular formula of 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride is C18H22N2O.
What is the molecular weight of 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride?
The molecular weight of 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride is 282.17 g/mol.
Where can I buy 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride?
You can request a quote for 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 6-Allyl-3-methyl-2,3,3a,4,5,6-hexahydro-6-canthinol hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.