Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)-
TL;DR: Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)- (CAS 115178-32-0) is a chemical compound with molecular formula C21H26N4 and molecular weight 334.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aR,9S)-9-[(2-ethylimidazol-1-yl)methyl]-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline
Also Known As: 8-((2-Ethyl-1H-imidazol-1-yl)methyl)-6-methylergoline (8-alpha)-, Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)-, Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-beta)-, RefChem:1084188
| Molecular Formula | C21H26N4 |
|---|---|
| Molecular Weight | 334.22 g/mol |
| LogP | 3.587 |
| Topological Polar Surface Area | 36.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.21576 |
| Heavy Atoms | 25 |
| Complexity | 905.6568 |
Chemical Identifiers
| CAS Number | 115178-32-0 |
|---|---|
| SMILES | CCC1=NC=CN1C[C@H]2CC3[C@@H](CC4=CNC5=CC=CC3=C45)N(C2)C |
Product Overview
Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)- (CAS 115178-32-0), with molecular formula C21H26N4 and molecular weight 334.22 g/mol. IUPAC: (6aR,9S)-9-[(2-ethylimidazol-1-yl)methyl]-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline.
Chemical Property Profile of Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)-
Property Insights of Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)-
The XLogP value of 3.587 indicates that Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.85 Ų, Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)- 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, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)-?
The CAS number of Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)- is 115178-32-0.
What is the molecular formula of Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)-?
The molecular formula of Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)- is C21H26N4.
What is the molecular weight of Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)-?
The molecular weight of Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)- is 334.22 g/mol.
Where can I buy Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)-?
You can request a quote for Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)-?
Yes, KEHONG BIO provides custom synthesis services for Ergoline, 8-((2-ethyl-1H-imidazol-1-yl)methyl)-6-methyl-, (8-alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.