3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate
TL;DR: 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate (CAS 7598-79-0) is a chemical compound with molecular formula C21H25NO4 and molecular weight 355.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9-methoxy-3,6-dimethyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl) acetate
Also Known As: 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate, (9-methoxy-3,6-dimethyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl) acetate
| Molecular Formula | C21H25NO4 |
|---|---|
| Molecular Weight | 355.18 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 355.17834 |
| Heavy Atoms | 26 |
| Complexity | 660.0 |
Chemical Identifiers
| CAS Number | 7598-79-0 |
|---|---|
| SMILES | CC1=C(C2C34CCN(C(C3C1)CC5=C4C(=C(C=C5)OC)O2)C)OC(=O)C |
| InChIKey | YEHPWZSOFCYYES-UHFFFAOYSA-N |
Product Overview
3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate (CAS 7598-79-0), with molecular formula C21H25NO4 and molecular weight 355.18 g/mol. IUPAC: (9-methoxy-3,6-dimethyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl) acetate.
Chemical Property Profile of 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate
Property Insights of 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate. With a topological polar surface area (TPSA) of 48.0 Ų, 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate has 0 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 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate?
The CAS number of 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate is 7598-79-0.
What is the molecular formula of 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate?
The molecular formula of 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate is C21H25NO4.
What is the molecular weight of 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate?
The molecular weight of 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate is 355.18 g/mol.
Where can I buy 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate?
You can request a quote for 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-7,17-dimethyl-6,7-didehydro-4,5-epoxymorphinan-6-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.