Dihydrostrychine methochloride
TL;DR: Dihydrostrychine methochloride (CAS 14896-70-9) is a chemical compound with molecular formula C22H27ClN2O2 and molecular weight 386.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,4aS,5aS,13aS,15aS,15bR)-6-methyl-3,4,4a,5,5a,7,8,13a,15,15a,15b,16-dodecahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-6-ium-14-one chloride
Also Known As: Dihydrostrychine methochloride, 21,22-Dihydro-19-methylstrychninium chloride, 19-Methyl-21,22-dihydrostrychnin-19-ium chloride, Strychninium, 21,22-dihydro-19-methyl-, chloride, 19-Methyl-10-oxo-21,22-dihydrostrychnidin-19-ium chloride
| Molecular Formula | C22H27ClN2O2 |
|---|---|
| Molecular Weight | 386.18 g/mol |
| LogP | -0.679 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 386.17612 |
| Heavy Atoms | 27 |
| Complexity | 681.0 |
Chemical Identifiers
| CAS Number | 14896-70-9 |
|---|---|
| SMILES | C[N+]12CCC34[C@@H]1C[C@H]5[C@@H](C2)CCO[C@@H]6[C@H]5[C@@H]3N(C(=O)C6)C7=CC=CC=C47.[Cl-] |
| InChIKey | UZFISBHCTKAZOV-QNYMNQTJSA-M |
Product Overview
Dihydrostrychine methochloride (CAS 14896-70-9), with molecular formula C22H27ClN2O2 and molecular weight 386.18 g/mol. IUPAC: (4S,4aS,5aS,13aS,15aS,15bR)-6-methyl-3,4,4a,5,5a,7,8,13a,15,15a,15b,16-dodecahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-6-ium-14-one chloride.
Chemical Property Profile of Dihydrostrychine methochloride
Property Insights of Dihydrostrychine methochloride
The XLogP value of -0.679 indicates that Dihydrostrychine methochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.5 Ų, Dihydrostrychine methochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihydrostrychine methochloride 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 Dihydrostrychine methochloride?
The CAS number of Dihydrostrychine methochloride is 14896-70-9.
What is the molecular formula of Dihydrostrychine methochloride?
The molecular formula of Dihydrostrychine methochloride is C22H27ClN2O2.
What is the molecular weight of Dihydrostrychine methochloride?
The molecular weight of Dihydrostrychine methochloride is 386.18 g/mol.
Where can I buy Dihydrostrychine methochloride?
You can request a quote for Dihydrostrychine methochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydrostrychine methochloride?
Yes, KEHONG BIO provides custom synthesis services for Dihydrostrychine methochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.