Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)-
TL;DR: Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)- (CAS 85329-87-9) is a chemical compound with molecular formula C21H26N4O2 and molecular weight 366.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aR,9R)-N-(ethylcarbamoyl)-7-prop-2-enyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
Also Known As: N-((Ethylamino)carbonyl)-6-(2-propenyl)ergoline-8-beta-carboxamide, Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)-, (10xi)-N-[(Ethylimino)(hydroxy)methyl]-6-(prop-2-en-1-yl)ergoline-8beta-carboximidic acid, N-[(Ethylimino)(hydroxy)methyl]-6-(prop-2-en-1-yl)ergoline-8-carboximidic acid, BRN 6009687
| Molecular Formula | C21H26N4O2 |
|---|---|
| Molecular Weight | 366.21 g/mol |
| LogP | 2.5298 |
| Topological Polar Surface Area | 77.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.20557 |
| Heavy Atoms | 27 |
| Complexity | 887.434 |
Chemical Identifiers
| CAS Number | 85329-87-9 |
|---|---|
| SMILES | CCNC(=O)NC(=O)[C@@H]1CC2[C@@H](CC3=CNC4=CC=CC2=C34)N(C1)CC=C |
Product Overview
Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)- (CAS 85329-87-9), with molecular formula C21H26N4O2 and molecular weight 366.21 g/mol. IUPAC: (6aR,9R)-N-(ethylcarbamoyl)-7-prop-2-enyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide.
Chemical Property Profile of Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)-
Property Insights of Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)-
The XLogP value of 2.5298 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)-. The TPSA of 77.23 Ų falls within the moderate polarity range, balancing permeability and solubility for Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)-. Following Lipinski's Rule of Five, Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)- has 3 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-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)-?
The CAS number of Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)- is 85329-87-9.
What is the molecular formula of Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)-?
The molecular formula of Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)- is C21H26N4O2.
What is the molecular weight of Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)-?
The molecular weight of Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)- is 366.21 g/mol.
Where can I buy Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)-?
You can request a quote for Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (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-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)-?
Yes, KEHONG BIO provides custom synthesis services for Ergoline-8-carboxamide, N-((ethylamino)carbonyl)-6-(2-propenyl)-, (8-beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.