Dehydroemetine hydrochloride, (+/-)-
TL;DR: Dehydroemetine hydrochloride, (+/-)- (CAS 14358-43-1) is a chemical compound with molecular formula C29H39ClN2O4 and molecular weight 514.2598 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(11bS)-2-[[(1R)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-3-ethyl-9,10-dimethoxy-4,6,7,11b-tetrahydro-1H-benzo[a]quinolizine;hydrochloride
Also Known As: Dehydroemetine, Emetine, dehydro-, dehydroemetine hydrochloride, Dehydroemetine (+-)-form HCl, Dehydroemetine (+-)-form dihydrochloride
Technical Specifications
| Molecular Formula | C29H39ClN2O4 |
| Molecular Weight | 514.2598 g/mol |
| XLogP | 5.4294 |
| Topological Polar Surface Area (TPSA) | 52.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 514.2598 Da |
| Heavy Atoms | 36 |
| Complexity | 744.0 |
| SMILES | CCC1=C(C[C@H]2C3=CC(=C(C=C3CCN2C1)OC)OC)C[C@@H]4C5=CC(=C(C=C5CCN4)OC)OC.Cl |
| InChIKey | DHRVPMDKONQKAP-KGQXAQPSSA-N |
Chemical Property Profile of Dehydroemetine hydrochloride, (+/-)-
Property Insights of Dehydroemetine hydrochloride, (+/-)-
The XLogP value of 5.4294 indicates that Dehydroemetine hydrochloride, (+/-)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.2 Ų, Dehydroemetine hydrochloride, (+/-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dehydroemetine hydrochloride, (+/-)- has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Dehydroemetine hydrochloride, (+/-)-?
The CAS number of Dehydroemetine hydrochloride, (+/-)- is 14358-43-1.
What is the molecular formula of Dehydroemetine hydrochloride, (+/-)-?
The molecular formula of Dehydroemetine hydrochloride, (+/-)- is C29H39ClN2O4.
What is the molecular weight of Dehydroemetine hydrochloride, (+/-)-?
The molecular weight of Dehydroemetine hydrochloride, (+/-)- is 514.2598 g/mol.
Where can I buy Dehydroemetine hydrochloride, (+/-)-?
You can request a quote for Dehydroemetine hydrochloride, (+/-)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dehydroemetine hydrochloride, (+/-)-?
Yes, CoreyChem provides custom synthesis services for Dehydroemetine hydrochloride, (+/-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.