Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)-
TL;DR: Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)- (CAS 74627-42-2) is a chemical compound with molecular formula C19H21BrN4O and molecular weight 400.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(6aR,9S)-5-bromo-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-9-yl]-2-cyanopropanamide
Also Known As: 2-Bromo-alpha-cyano-6-methylergoline-8-propionamide, Ergoline-8-propanamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)-, Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)-, 3-(2-Bromo-6-methylergolin-8-yl)-2-cyanopropanimidic acid, 3-[(10xi)-2-Bromo-6-methylergolin-8beta-yl]-2-cyanopropanimidic acid
| Molecular Formula | C19H21BrN4O |
|---|---|
| Molecular Weight | 400.09 g/mol |
| LogP | 2.90558 |
| Topological Polar Surface Area | 85.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 400.08987 |
| Heavy Atoms | 25 |
| Complexity | 883.4118 |
Chemical Identifiers
| CAS Number | 74627-42-2 |
|---|---|
| SMILES | CN1C[C@@H](CC2[C@H]1CC3=C(NC4=CC=CC2=C34)Br)CC(C#N)C(=O)N |
Product Overview
Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)- (CAS 74627-42-2), with molecular formula C19H21BrN4O and molecular weight 400.09 g/mol. IUPAC: 3-[(6aR,9S)-5-bromo-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-9-yl]-2-cyanopropanamide.
Chemical Property Profile of Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)-
Property Insights of Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)-
The XLogP value of 2.90558 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)-. The TPSA of 85.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)-. Following Lipinski's Rule of Five, Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)- has 2 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-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)-?
The CAS number of Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)- is 74627-42-2.
What is the molecular formula of Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)-?
The molecular formula of Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)- is C19H21BrN4O.
What is the molecular weight of Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)-?
The molecular weight of Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)- is 400.09 g/mol.
Where can I buy Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)-?
You can request a quote for Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (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-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)-?
Yes, KEHONG BIO provides custom synthesis services for Ergoline-8-propionamide, 2-bromo-alpha-cyano-6-methyl-, (8-beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.