3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium
TL;DR: 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium (CAS 7241-18-1) is a chemical compound with molecular formula C17H20NO4+ and molecular weight 302.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4a,9-dihydroxy-3-methyl-1,2,3,4,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-one
Also Known As: 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium
| Molecular Formula | C17H20NO4+ |
|---|---|
| Molecular Weight | 302.14 g/mol |
| LogP | -0.6719 |
| Topological Polar Surface Area | 71.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 302.13922 |
| Heavy Atoms | 22 |
| Complexity | 716.85565 |
Chemical Identifiers
| CAS Number | 7241-18-1 |
|---|---|
| SMILES | C[NH+]1CCC23C4C(=O)CCC2(C1CC5=C3C(=C(C=C5)O)O4)O |
Product Overview
3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium (CAS 7241-18-1), with molecular formula C17H20NO4+ and molecular weight 302.14 g/mol. IUPAC: 4a,9-dihydroxy-3-methyl-1,2,3,4,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7-one.
Chemical Property Profile of 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium
Property Insights of 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium
The XLogP value of -0.6719 indicates that 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium. Following Lipinski's Rule of Five, 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium has 3 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 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium?
The CAS number of 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium is 7241-18-1.
What is the molecular formula of 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium?
The molecular formula of 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium is C17H20NO4+.
What is the molecular weight of 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium?
The molecular weight of 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium is 302.14 g/mol.
Where can I buy 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium?
You can request a quote for 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium?
Yes, KEHONG BIO provides custom synthesis services for 3,14-Dihydroxy-17-methyl-6-oxo-4,5-epoxymorphinan-17-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.