Pseudocodeine
TL;DR: Pseudocodeine (CAS 466-96-6) is a chemical compound with molecular formula C18H21NO3 and molecular weight 299.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,4aR,5S,7aS,12bS)-9-methoxy-3-methyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-5-ol
Also Known As: Pseudocodeine, Neoisocodeine, psi-Codeine, .OMEGA.-CODEINE, OMEGA-CODEINE
| Molecular Formula | C18H21NO3 |
|---|---|
| Molecular Weight | 299.15 g/mol |
| LogP | 1.5011 |
| Topological Polar Surface Area | 41.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 299.15213 |
| Heavy Atoms | 22 |
| Complexity | 685.15497 |
Chemical Identifiers
| CAS Number | 466-96-6 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4C=C[C@@H]([C@H]2[C@H]1CC5=C3C(=C(C=C5)OC)O4)O |
Product Overview
Pseudocodeine (CAS 466-96-6), with molecular formula C18H21NO3 and molecular weight 299.15 g/mol. IUPAC: (4R,4aR,5S,7aS,12bS)-9-methoxy-3-methyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-5-ol.
Chemical Property Profile of Pseudocodeine
Property Insights of Pseudocodeine
The XLogP value of 1.5011 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudocodeine. With a topological polar surface area (TPSA) of 41.93 Ų, Pseudocodeine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pseudocodeine has 1 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 Pseudocodeine?
The CAS number of Pseudocodeine is 466-96-6.
What is the molecular formula of Pseudocodeine?
The molecular formula of Pseudocodeine is C18H21NO3.
What is the molecular weight of Pseudocodeine?
The molecular weight of Pseudocodeine is 299.15 g/mol.
Where can I buy Pseudocodeine?
You can request a quote for Pseudocodeine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudocodeine?
Yes, KEHONG BIO provides custom synthesis services for Pseudocodeine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.