Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)-
TL;DR: Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)- (CAS 162070-34-0) is a chemical compound with molecular formula C19H21ClN4 and molecular weight 340.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aR,9S)-5-chloro-9-(imidazol-1-ylmethyl)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline
Also Known As: (5R,8S,10R)-2-Chloro-6-methyl-8-(1H-imidazol-1-ylmethyl)ergoline, diethyl 2-ethoxythiocarbonylsulfanylmalonate, 2-Chloro-6-methyl-8-alpha-(1H-imidazol-1-ylmethyl)ergoline, Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)-, (8
| Molecular Formula | C19H21ClN4 |
|---|---|
| Molecular Weight | 340.15 g/mol |
| LogP | 3.678 |
| Topological Polar Surface Area | 36.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 340.14548 |
| Heavy Atoms | 24 |
| Complexity | 882.299 |
Chemical Identifiers
| CAS Number | 162070-34-0 |
|---|---|
| SMILES | CN1C[C@H](CC2[C@H]1CC3=C(NC4=CC=CC2=C34)Cl)CN5C=CN=C5 |
Product Overview
Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)- (CAS 162070-34-0), with molecular formula C19H21ClN4 and molecular weight 340.15 g/mol. IUPAC: (6aR,9S)-5-chloro-9-(imidazol-1-ylmethyl)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline.
Chemical Property Profile of Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)-
Property Insights of Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)-
The XLogP value of 3.678 indicates that Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-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, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-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, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)-?
The CAS number of Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)- is 162070-34-0.
What is the molecular formula of Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)-?
The molecular formula of Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)- is C19H21ClN4.
What is the molecular weight of Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)-?
The molecular weight of Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)- is 340.15 g/mol.
Where can I buy Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)-?
You can request a quote for Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-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, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)-?
Yes, KEHONG BIO provides custom synthesis services for Ergoline, 2-chloro-8-(1H-imidazol-1-ylmethyl)-6-methyl-, (8-alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.