6-Ketoapovincamine
TL;DR: 6-Ketoapovincamine (CAS 65825-92-5) 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.
methyl (15S,19S)-15-ethyl-9-oxo-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18),16-pentaene-17-carboxylate
Also Known As: 6-Oxoapovincamine, 6-Ketoapovincamine, Eburnamenine-14-carboxylic acid, 6-oxo-, methyl ester, (3-alpha,16-alpha)-, Methyl (3-alpha,16-alpha)-6-oxoeburnamenine-14-carboxylate, Methyl 6-oxo-3alpha,16alpha-eburnamenine-14-carboxylate
| Molecular Formula | C21H22N2O3 |
|---|---|
| Molecular Weight | 350.16 g/mol |
| LogP | 3.3984 |
| Topological Polar Surface Area | 51.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 350.16306 |
| Heavy Atoms | 26 |
| Complexity | 986.5478 |
Chemical Identifiers
| CAS Number | 65825-92-5 |
|---|---|
| SMILES | CC[C@@]12CCCN3[C@@H]1C4=C(C(=O)C3)C5=CC=CC=C5N4C(=C2)C(=O)OC |
Product Overview
6-Ketoapovincamine (CAS 65825-92-5), with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol. IUPAC: methyl (15S,19S)-15-ethyl-9-oxo-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18),16-pentaene-17-carboxylate.
Chemical Property Profile of 6-Ketoapovincamine
Property Insights of 6-Ketoapovincamine
The XLogP value of 3.3984 indicates that 6-Ketoapovincamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.54 Ų, 6-Ketoapovincamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Ketoapovincamine has 0 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 6-Ketoapovincamine?
The CAS number of 6-Ketoapovincamine is 65825-92-5.
What is the molecular formula of 6-Ketoapovincamine?
The molecular formula of 6-Ketoapovincamine is C21H22N2O3.
What is the molecular weight of 6-Ketoapovincamine?
The molecular weight of 6-Ketoapovincamine is 350.16 g/mol.
Where can I buy 6-Ketoapovincamine?
You can request a quote for 6-Ketoapovincamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Ketoapovincamine?
Yes, KEHONG BIO provides custom synthesis services for 6-Ketoapovincamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.