O-Ethylhydroxylupanine
TL;DR: O-Ethylhydroxylupanine (CAS 64457-66-5) is a chemical compound with molecular formula C17H28N2O2 and molecular weight 292.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2S,9R,10S,12S)-12-ethoxy-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-6-one
Also Known As: 13-Ethoxylupanin, O-Ethyloxylupanine, O-Ethylhydroxylupanine, 13alpha-Ethoxylupanine, 13-Ethoxyspartein-2-one
| Molecular Formula | C17H28N2O2 |
|---|---|
| Molecular Weight | 292.22 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.2151 |
| Heavy Atoms | 21 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 64457-66-5 |
|---|---|
| SMILES | CCO[C@H]1CCN2C[C@H]3C[C@@H]([C@@H]2C1)CN4[C@H]3CCCC4=O |
| InChIKey | ZMZWSDSAHBYZTQ-OWYFMNJBSA-N |
Product Overview
O-Ethylhydroxylupanine (CAS 64457-66-5), with molecular formula C17H28N2O2 and molecular weight 292.22 g/mol. IUPAC: (1R,2S,9R,10S,12S)-12-ethoxy-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-6-one.
Chemical Property Profile of O-Ethylhydroxylupanine
Property Insights of O-Ethylhydroxylupanine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-Ethylhydroxylupanine. With a topological polar surface area (TPSA) of 32.8 Ų, O-Ethylhydroxylupanine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-Ethylhydroxylupanine has 0 hydrogen bond donor(s) and 3 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 O-Ethylhydroxylupanine?
The CAS number of O-Ethylhydroxylupanine is 64457-66-5.
What is the molecular formula of O-Ethylhydroxylupanine?
The molecular formula of O-Ethylhydroxylupanine is C17H28N2O2.
What is the molecular weight of O-Ethylhydroxylupanine?
The molecular weight of O-Ethylhydroxylupanine is 292.22 g/mol.
Where can I buy O-Ethylhydroxylupanine?
You can request a quote for O-Ethylhydroxylupanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-Ethylhydroxylupanine?
Yes, KEHONG BIO provides custom synthesis services for O-Ethylhydroxylupanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.