Codeine epoxide
TL;DR: Codeine epoxide (CAS 72785-20-7) is a chemical compound with molecular formula C18H21NO4 and molecular weight 315.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,5R,13S,14R,15R,17S,18R)-10-methoxy-4-methyl-12,16-dioxa-4-azahexacyclo[9.7.1.01,13.05,18.07,19.015,17]nonadeca-7(19),8,10-trien-14-ol
Also Known As: Codeine epoxide, 8-Methoxy-2-methyl-1,3,4,9a,10,10a,11a,11b-octahydro-2H-1,5-methano[1]benzofuro[3,2-e]oxireno[h]isoquinolin-10-ol, (1R,4aS,9aS,10R,10aR,11aS,11bR)-8-Methoxy-2-methyl-1,3,4,9a,10,10a,11a,11b-octahydro-2H-1,5-methano[1]benzofuro[3,2-e]oxireno[h]isoquinolin-10-ol, (1S,5R,13S,14R,15R,17S,18R)-10-Methoxy-4-methyl-12,16-dioxa-4-azahexacyclo[9.7.1.01,13.05,18.07,19.015,17]nonadeca-7(19),8,10-trien-14-ol
| Molecular Formula | C18H21NO4 |
|---|---|
| Molecular Weight | 315.15 g/mol |
| LogP | 0.7123 |
| Topological Polar Surface Area | 54.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 315.14706 |
| Heavy Atoms | 23 |
| Complexity | 721.21826 |
Chemical Identifiers
| CAS Number | 72785-20-7 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@@H]3[C@H]([C@@H]6[C@H]4O6)O |
Product Overview
Codeine epoxide (CAS 72785-20-7), with molecular formula C18H21NO4 and molecular weight 315.15 g/mol. IUPAC: (1S,5R,13S,14R,15R,17S,18R)-10-methoxy-4-methyl-12,16-dioxa-4-azahexacyclo[9.7.1.01,13.05,18.07,19.015,17]nonadeca-7(19),8,10-trien-14-ol.
Chemical Property Profile of Codeine epoxide
Property Insights of Codeine epoxide
The XLogP value of 0.7123 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Codeine epoxide. With a topological polar surface area (TPSA) of 54.46 Ų, Codeine epoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Codeine epoxide has 1 hydrogen bond donor(s) and 5 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 Codeine epoxide?
The CAS number of Codeine epoxide is 72785-20-7.
What is the molecular formula of Codeine epoxide?
The molecular formula of Codeine epoxide is C18H21NO4.
What is the molecular weight of Codeine epoxide?
The molecular weight of Codeine epoxide is 315.15 g/mol.
Where can I buy Codeine epoxide?
You can request a quote for Codeine epoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Codeine epoxide?
Yes, KEHONG BIO provides custom synthesis services for Codeine epoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.