Allopseudocodeine hydrochloride
TL;DR: Allopseudocodeine hydrochloride (CAS 63732-62-7) is a chemical compound with molecular formula C18H22ClNO3 and molecular weight 335.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,4aR,5R,7aS,12bS)-9-methoxy-3-methyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-5-ol;hydrochloride
Also Known As: Allopseudocodeine hydrochloride, Pseudocodeine, hydrochloride, Morphinan-8-alpha-ol, 6,7-didehydro-4,5-alpha-epoxy-3-methoxy-17-methyl-, hydrochloride, 3-Methoxy-17-methyl-5alpha-6,7-didehydro-4,5-epoxymorphinan-8alpha-ol--hydrogen chloride (1/1), Morphinan-8-ol, 6,7-didehydro-4,5-epoxy-3-methoxy-17-methyl-, hydrochloride, (5.alpha.,8.alpha.)-
| Molecular Formula | C18H22ClNO3 |
|---|---|
| Molecular Weight | 335.13 g/mol |
| LogP | 1.9229 |
| Topological Polar Surface Area | 41.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 335.1288 |
| Heavy Atoms | 23 |
| Complexity | 691.0894 |
Chemical Identifiers
| CAS Number | 63732-62-7 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4C=C[C@H]([C@H]2[C@H]1CC5=C3C(=C(C=C5)OC)O4)O.Cl |
Product Overview
Allopseudocodeine hydrochloride (CAS 63732-62-7), with molecular formula C18H22ClNO3 and molecular weight 335.13 g/mol. IUPAC: (4R,4aR,5R,7aS,12bS)-9-methoxy-3-methyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-5-ol;hydrochloride.
Chemical Property Profile of Allopseudocodeine hydrochloride
Property Insights of Allopseudocodeine hydrochloride
The XLogP value of 1.9229 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Allopseudocodeine hydrochloride. With a topological polar surface area (TPSA) of 41.93 Ų, Allopseudocodeine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allopseudocodeine hydrochloride 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 Allopseudocodeine hydrochloride?
The CAS number of Allopseudocodeine hydrochloride is 63732-62-7.
What is the molecular formula of Allopseudocodeine hydrochloride?
The molecular formula of Allopseudocodeine hydrochloride is C18H22ClNO3.
What is the molecular weight of Allopseudocodeine hydrochloride?
The molecular weight of Allopseudocodeine hydrochloride is 335.13 g/mol.
Where can I buy Allopseudocodeine hydrochloride?
You can request a quote for Allopseudocodeine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allopseudocodeine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Allopseudocodeine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.