2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one
TL;DR: 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one (CAS 60606-95-3) is a chemical compound with molecular formula C23H26N2O4 and molecular weight 394.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10,11-dimethoxy-3,4a,5,5a,7,8,13a,15,15a,15b-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one
Also Known As: Neobrucine, NCI60_000554, 2,3-dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one, 2,3-dimethoxy-20,21-didehydro-21,22-dihydrostrychnidin-10-one, 10,11-dimethoxy-3,4a,5,5a,7,8,13a,15,15a,15b-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one
| Molecular Formula | C23H26N2O4 |
|---|---|
| Molecular Weight | 394.19 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 394.18927 |
| Heavy Atoms | 29 |
| Complexity | 785.0 |
Chemical Identifiers
| CAS Number | 60606-95-3 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C34CCN5C3CC6C7C4N2C(=O)CC7OCCC6=C5)OC |
| InChIKey | BUQWXEFUPCTDBF-UHFFFAOYSA-N |
Product Overview
2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one (CAS 60606-95-3), with molecular formula C23H26N2O4 and molecular weight 394.19 g/mol. IUPAC: 10,11-dimethoxy-3,4a,5,5a,7,8,13a,15,15a,15b-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 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one
Property Insights of 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one. With a topological polar surface area (TPSA) of 51.2 Ų, 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one 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 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one?
The CAS number of 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one is 60606-95-3.
What is the molecular formula of 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one?
The molecular formula of 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one is C23H26N2O4.
What is the molecular weight of 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one?
The molecular weight of 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one is 394.19 g/mol.
Where can I buy 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one?
You can request a quote for 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dimethoxy-1,20-didehydro-1,22-dihydrostrychnidin-10-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.