Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)-
TL;DR: Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)- (CAS 160730-58-5) is a chemical compound with molecular formula C19H23N5 and molecular weight 321.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aR,9R)-7-ethyl-9-(1,2,4-triazol-1-ylmethyl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline
Also Known As: 6-Ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)ergoline (8-beta)-, Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)-, 6-Ethyl-8-[(1H-1,2,4-triazol-1-yl)methyl]ergoline, (10xi)-6-Ethyl-8beta-[(1H-1,2,4-triazol-1-yl)methyl]ergoline, RefChem:339656
| Molecular Formula | C19H23N5 |
|---|---|
| Molecular Weight | 321.20 g/mol |
| LogP | 2.8097 |
| Topological Polar Surface Area | 49.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.19534 |
| Heavy Atoms | 24 |
| Complexity | 849.9045 |
Chemical Identifiers
| CAS Number | 160730-58-5 |
|---|---|
| SMILES | CCN1C[C@@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)CN5C=NC=N5 |
Product Overview
Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)- (CAS 160730-58-5), with molecular formula C19H23N5 and molecular weight 321.20 g/mol. IUPAC: (6aR,9R)-7-ethyl-9-(1,2,4-triazol-1-ylmethyl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline.
Chemical Property Profile of Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)-
Property Insights of Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)-
The XLogP value of 2.8097 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)-. With a topological polar surface area (TPSA) of 49.74 Ų, Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)- has 1 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 Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)-?
The CAS number of Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)- is 160730-58-5.
What is the molecular formula of Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)-?
The molecular formula of Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)- is C19H23N5.
What is the molecular weight of Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)-?
The molecular weight of Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)- is 321.20 g/mol.
Where can I buy Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)-?
You can request a quote for Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (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, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)-?
Yes, KEHONG BIO provides custom synthesis services for Ergoline, 6-ethyl-8-(1H-1,2,4-triazol-1-ylmethyl)-, (8-beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.