Ketoyobirine
TL;DR: Ketoyobirine (CAS 6879-87-4) is a chemical compound with molecular formula C20H16N2O and molecular weight 300.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
19-methyl-11,12-dihydro-3H-yohimban-14-one
Also Known As: Ketoyobirine, 16-methyl-3,14,15,16,17,18,19,20-octadehydroyohimban-21-one
| Molecular Formula | C20H16N2O |
|---|---|
| Molecular Weight | 300.13 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 36.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 300.12625 |
| Heavy Atoms | 23 |
| Complexity | 542.0 |
Chemical Identifiers
| CAS Number | 6879-87-4 |
|---|---|
| SMILES | CC1=C2C=C3C4=C(CCN3C(=O)C2=CC=C1)C5=CC=CC=C5N4 |
| InChIKey | JBPJPSRMGPRHFZ-UHFFFAOYSA-N |
Product Overview
Ketoyobirine (CAS 6879-87-4), with molecular formula C20H16N2O and molecular weight 300.13 g/mol. IUPAC: 19-methyl-11,12-dihydro-3H-yohimban-14-one.
Chemical Property Profile of Ketoyobirine
Property Insights of Ketoyobirine
The XLogP value of 3.7 indicates that Ketoyobirine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.1 Ų, Ketoyobirine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ketoyobirine has 1 hydrogen bond donor(s) and 1 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 Ketoyobirine?
The CAS number of Ketoyobirine is 6879-87-4.
What is the molecular formula of Ketoyobirine?
The molecular formula of Ketoyobirine is C20H16N2O.
What is the molecular weight of Ketoyobirine?
The molecular weight of Ketoyobirine is 300.13 g/mol.
Where can I buy Ketoyobirine?
You can request a quote for Ketoyobirine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ketoyobirine?
Yes, KEHONG BIO provides custom synthesis services for Ketoyobirine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.