轮环藤酚碱
TL;DR: 轮环藤酚碱 (CAS 18556-27-9) is a chemical compound with molecular formula C20H24NO4+ and molecular weight 342.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
轮环藤酚碱
3,10-dimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-2,9-diol
Also Known As: Cyclanoline, Cissamine, (-)-Cyclanolin, Cyclanoline (chloride), NCI60_030399
| Molecular Formula | C20H24NO4+ |
|---|---|
| Molecular Weight | 342.17 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 342.17053 |
| Heavy Atoms | 25 |
| Complexity | 488.0 |
Chemical Identifiers
| CAS Number | 18556-27-9 |
|---|---|
| SMILES | C[N+]12CCC3=CC(=C(C=C3C1CC4=C(C2)C(=C(C=C4)OC)O)O)OC |
| InChIKey | LKLWVKCEYSPQHL-UHFFFAOYSA-O |
Product Overview
轮环藤酚碱 (CAS 18556-27-9), with molecular formula C20H24NO4+ and molecular weight 342.17 g/mol. IUPAC: 3,10-dimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-2,9-diol.
Chemical Property Profile of 轮环藤酚碱
Property Insights of 轮环藤酚碱
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 轮环藤酚碱. With a topological polar surface area (TPSA) of 58.9 Ų, 轮环藤酚碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 轮环藤酚碱 has 2 hydrogen bond donor(s) and 4 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 轮环藤酚碱?
The CAS number of 轮环藤酚碱 is 18556-27-9.
What is the molecular formula of 轮环藤酚碱?
The molecular formula of 轮环藤酚碱 is C20H24NO4+.
What is the molecular weight of 轮环藤酚碱?
The molecular weight of 轮环藤酚碱 is 342.17 g/mol.
Where can I buy 轮环藤酚碱?
You can request a quote for 轮环藤酚碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 轮环藤酚碱?
Yes, KEHONG BIO provides custom synthesis services for 轮环藤酚碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.