(5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one
TL;DR: (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one (CAS 34707-87-4) is a chemical compound with molecular formula C19H21NO7S and molecular weight 407.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4R,4aS,7aR,12bS)-4a-hydroxy-7-oxo-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl] hydrogen sulfate
Also Known As: Naloxone-3-sulfate, Naloxone-3-ethereal sulfate, 4,5alpha-Epoxy-17-allyl-14-hydroxy-6-oxomorphinan-3-ol 3-sulfate, Morphinan-6-one, 4,5-epoxy-14-hydroxy-17-(2-propenyl)-3-(sulfooxy)-, (5alpha)-, (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one
| Molecular Formula | C19H21NO7S |
|---|---|
| Molecular Weight | 407.10 g/mol |
| LogP | 0.7774 |
| Topological Polar Surface Area | 113.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.10388 |
| Heavy Atoms | 28 |
| Complexity | 1005.77966 |
Chemical Identifiers
| CAS Number | 34707-87-4 |
|---|---|
| SMILES | C=CCN1CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)OS(=O)(=O)O)O4)O |
Product Overview
(5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one (CAS 34707-87-4), with molecular formula C19H21NO7S and molecular weight 407.10 g/mol. IUPAC: [(4R,4aS,7aR,12bS)-4a-hydroxy-7-oxo-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl] hydrogen sulfate.
Chemical Property Profile of (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one
Property Insights of (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one
The XLogP value of 0.7774 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one. The TPSA of 113.37 Ų falls within the moderate polarity range, balancing permeability and solubility for (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one. Following Lipinski's Rule of Five, (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one has 2 hydrogen bond donor(s) and 7 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 (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one?
The CAS number of (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one is 34707-87-4.
What is the molecular formula of (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one?
The molecular formula of (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one is C19H21NO7S.
What is the molecular weight of (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one?
The molecular weight of (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one is 407.10 g/mol.
Where can I buy (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one?
You can request a quote for (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one?
Yes, KEHONG BIO provides custom synthesis services for (5alpha)-4,5-Epoxy-14-hydroxy-17-(2-propen-1-yl)-3-(sulfooxy)morphinan-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.