番木鳖碱
TL;DR: 番木鳖碱 (CAS 57-24-9) is a chemical compound with molecular formula C21H22N2O2 and molecular weight 334.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
番木鳖碱
4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one
Also Known As: strychnine, Strychnin, Strychnos, Strychnidin-10-one, Sanaseed
| Molecular Formula | C21H22N2O2 |
|---|---|
| Molecular Weight | 334.17 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 334.16812 |
| Heavy Atoms | 25 |
| Complexity | 689.0 |
Chemical Identifiers
| CAS Number | 57-24-9 |
|---|---|
| SMILES | C1CN2CC3=CCOC4CC(=O)N5C6C4C3CC2C61C7=CC=CC=C75 |
| InChIKey | QMGVPVSNSZLJIA-UHFFFAOYSA-N |
Product Overview
番木鳖碱 (CAS 57-24-9), with molecular formula C21H22N2O2 and molecular weight 334.17 g/mol. IUPAC: 4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one.
Chemical Property Profile of 番木鳖碱
Property Insights of 番木鳖碱
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 番木鳖碱. With a topological polar surface area (TPSA) of 32.8 Ų, 番木鳖碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 番木鳖碱 has 0 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 番木鳖碱?
The CAS number of 番木鳖碱 is 57-24-9.
What is the molecular formula of 番木鳖碱?
The molecular formula of 番木鳖碱 is C21H22N2O2.
What is the molecular weight of 番木鳖碱?
The molecular weight of 番木鳖碱 is 334.17 g/mol.
Where can I buy 番木鳖碱?
You can request a quote for 番木鳖碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 番木鳖碱?
Yes, KEHONG BIO provides custom synthesis services for 番木鳖碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.