6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline
TL;DR: 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline (CAS 116979-29-4) is a chemical compound with molecular formula C19H22N4 and molecular weight 306.18445 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6aR,9R)-7-methyl-9-(1-methylpyrazol-3-yl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline
Also Known As: FCE 21641, 6-Methyl-8-beta-(1-methyl-pyrazol-3-yl)ergoline, (8-beta)-6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline, 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline, Ergoline, 6-methyl-8-(1-methyl-1H-pyrazol-3-yl)-, (8-beta)-
Technical Specifications
| Molecular Formula | C19H22N4 |
| Molecular Weight | 306.18445 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 36.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 306.18445 Da |
| Heavy Atoms | 23 |
| Complexity | 455.0 |
| SMILES | CN1C[C@@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)C5=NN(C=C5)C |
| InChIKey | RHODJOABWUAPEL-JGNDPHQUSA-N |
Chemical Property Profile of 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline
Property Insights of 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline. With a topological polar surface area (TPSA) of 36.9 Ų, 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline 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
What is the CAS number of 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline?
The CAS number of 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline is 116979-29-4.
What is the molecular formula of 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline?
The molecular formula of 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline is C19H22N4.
What is the molecular weight of 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline?
The molecular weight of 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline is 306.18445 g/mol.
Where can I buy 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline?
You can request a quote for 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline?
Yes, CoreyChem provides custom synthesis services for 6-Methyl-8-(1-methyl-1H-pyrazol-3-yl)ergoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.