Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)-
TL;DR: Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)- (CAS 89930-64-3) is a chemical compound with molecular formula C17H22N2O and molecular weight 270.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(6aR,9R,10aR)-7,9-dimethyl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinolin-4-yl]methanol
Also Known As: 1-Hydroxymethylfestuclavine, (dimethyl[?]yl)methanol, Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)-, (8-beta)-6,8-Dimethylergoline-1-methanol, (6,8-Dimethylergolin-1-yl)methanol
| Molecular Formula | C17H22N2O |
|---|---|
| Molecular Weight | 270.17 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 28.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 270.17322 |
| Heavy Atoms | 20 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 89930-64-3 |
|---|---|
| SMILES | C[C@@H]1C[C@H]2[C@@H](CC3=CN(C4=CC=CC2=C34)CO)N(C1)C |
| InChIKey | ZRSYFDQOVJPDJB-DJSGYFEHSA-N |
Product Overview
Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)- (CAS 89930-64-3), with molecular formula C17H22N2O and molecular weight 270.17 g/mol. IUPAC: [(6aR,9R,10aR)-7,9-dimethyl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinolin-4-yl]methanol.
Chemical Property Profile of Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)-
Property Insights of Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)-. With a topological polar surface area (TPSA) of 28.4 Ų, Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)- has 1 hydrogen bond donor(s) and 2 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 Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)-?
The CAS number of Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)- is 89930-64-3.
What is the molecular formula of Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)-?
The molecular formula of Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)- is C17H22N2O.
What is the molecular weight of Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)-?
The molecular weight of Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)- is 270.17 g/mol.
Where can I buy Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)-?
You can request a quote for Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)-?
Yes, KEHONG BIO provides custom synthesis services for Ergoline-1-methanol, 6,8-dimethyl-, (8-beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.