Isoapocodeine
TL;DR: Isoapocodeine (CAS 41265-63-8) is a chemical compound with molecular formula C18H19NO2 and molecular weight 281.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aR)-11-methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-ol
Also Known As: Isoapocodeine, Isoapocodein, (6aR)-11-methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-ol, 4h-dibenzo(de,g)quinolin-10-ol, 5,6,6a,7-tetrahydro-11-methoxy-6-methyl-,(r)-, 11-Methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-ol
| Molecular Formula | C18H19NO2 |
|---|---|
| Molecular Weight | 281.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 281.14157 |
| Heavy Atoms | 21 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 41265-63-8 |
|---|---|
| SMILES | CN1CCC2=C3[C@H]1CC4=C(C3=CC=C2)C(=C(C=C4)O)OC |
| InChIKey | SMJNKYXAZPPMTE-CQSZACIVSA-N |
Product Overview
Isoapocodeine (CAS 41265-63-8), with molecular formula C18H19NO2 and molecular weight 281.14 g/mol. IUPAC: (6aR)-11-methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-ol.
Chemical Property Profile of Isoapocodeine
Property Insights of Isoapocodeine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isoapocodeine. With a topological polar surface area (TPSA) of 32.7 Ų, Isoapocodeine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoapocodeine 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 Isoapocodeine?
The CAS number of Isoapocodeine is 41265-63-8.
What is the molecular formula of Isoapocodeine?
The molecular formula of Isoapocodeine is C18H19NO2.
What is the molecular weight of Isoapocodeine?
The molecular weight of Isoapocodeine is 281.14 g/mol.
Where can I buy Isoapocodeine?
You can request a quote for Isoapocodeine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoapocodeine?
Yes, KEHONG BIO provides custom synthesis services for Isoapocodeine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.