尼麦角林
TL;DR: 尼麦角林 (CAS 27848-84-6) is a chemical compound with molecular formula C24H26BrN3O3 and molecular weight 483.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
尼麦角林
(10a-methoxy-4,7-dimethyl-6a,8,9,10-tetrahydro-6H-indolo[4,3-fg]quinolin-9-yl)methyl 5-bromopyridine-3-carboxylate
Also Known As: nicergoline, Nicotergoline, Nargoline, Vasospan, Sermion
| Molecular Formula | C24H26BrN3O3 |
|---|---|
| Molecular Weight | 483.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 56.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 483.11575 |
| Heavy Atoms | 31 |
| Complexity | 680.0 |
Chemical Identifiers
| CAS Number | 27848-84-6 |
|---|---|
| SMILES | CN1CC(CC2(C1CC3=CN(C4=CC=CC2=C34)C)OC)COC(=O)C5=CC(=CN=C5)Br |
| InChIKey | YSEXMKHXIOCEJA-UHFFFAOYSA-N |
Product Overview
尼麦角林 (CAS 27848-84-6), with molecular formula C24H26BrN3O3 and molecular weight 483.12 g/mol. IUPAC: (10a-methoxy-4,7-dimethyl-6a,8,9,10-tetrahydro-6H-indolo[4,3-fg]quinolin-9-yl)methyl 5-bromopyridine-3-carboxylate.
Chemical Property Profile of 尼麦角林
Property Insights of 尼麦角林
The XLogP value of 3.2 indicates that 尼麦角林 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.6 Ų, 尼麦角林 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 尼麦角林 has 0 hydrogen bond donor(s) and 5 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 尼麦角林?
The CAS number of 尼麦角林 is 27848-84-6.
What is the molecular formula of 尼麦角林?
The molecular formula of 尼麦角林 is C24H26BrN3O3.
What is the molecular weight of 尼麦角林?
The molecular weight of 尼麦角林 is 483.12 g/mol.
Where can I buy 尼麦角林?
You can request a quote for 尼麦角林 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 尼麦角林?
Yes, KEHONG BIO provides custom synthesis services for 尼麦角林 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.