4-Hydroxystrychnine
TL;DR: 4-Hydroxystrychnine (CAS 25576-40-3) is a chemical compound with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4aR,5aS,13aS,15aS,15bR)-12-hydroxy-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: 4-Hydroxystrychnine, hydroxy[?]one, 4-Hydroxystrychnidin-10-one, 12-hydroxystrychnine, 4-hydroxy-strychnine
| Molecular Formula | C21H22N2O3 |
|---|---|
| Molecular Weight | 350.16 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 350.16306 |
| Heavy Atoms | 26 |
| Complexity | 722.0 |
Chemical Identifiers
| CAS Number | 25576-40-3 |
|---|---|
| SMILES | C1CN2CC3=CCO[C@H]4CC(=O)N5[C@H]6[C@H]4[C@H]3C[C@H]2C61C7=C5C(=CC=C7)O |
| InChIKey | NZPSURVTGWFING-BEONAWIISA-N |
Product Overview
4-Hydroxystrychnine (CAS 25576-40-3), with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol. IUPAC: (4aR,5aS,13aS,15aS,15bR)-12-hydroxy-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 4-Hydroxystrychnine
Property Insights of 4-Hydroxystrychnine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxystrychnine. With a topological polar surface area (TPSA) of 53.0 Ų, 4-Hydroxystrychnine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxystrychnine has 1 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 4-Hydroxystrychnine?
The CAS number of 4-Hydroxystrychnine is 25576-40-3.
What is the molecular formula of 4-Hydroxystrychnine?
The molecular formula of 4-Hydroxystrychnine is C21H22N2O3.
What is the molecular weight of 4-Hydroxystrychnine?
The molecular weight of 4-Hydroxystrychnine is 350.16 g/mol.
Where can I buy 4-Hydroxystrychnine?
You can request a quote for 4-Hydroxystrychnine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxystrychnine?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxystrychnine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.