Cernuine
TL;DR: Cernuine (CAS 6880-84-8) is a chemical compound with molecular formula C16H26N2O and molecular weight 262.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,7S,9R,11S,13S)-11-methyl-2,17-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-3-one
Also Known As: Cernuine, 12-Deoxylycocernuine, (1S,7S,9R,11S,13S)-11-methyl-2,17-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-3-one, (1S,7S,9R,11S,13S)-11-methyl-2,17-diazatetracyclo(7.7.1.02,7.013,17)heptadecan-3-one, (3aS)-1,2,3,3a,4,5,6,6abeta,7,7abeta,8,9,10,12aalpha-Tetradecahydro-5alpha-methyl-11H-pyrido[1 ,2 :3,4]pyrimido[2,1,6-de]quinolizin-11-one
| Molecular Formula | C16H26N2O |
|---|---|
| Molecular Weight | 262.20 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 262.2045 |
| Heavy Atoms | 19 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 6880-84-8 |
|---|---|
| SMILES | C[C@H]1C[C@@H]2CCC[C@H]3N2[C@H](C1)C[C@H]4N3C(=O)CCC4 |
| InChIKey | IWSJXTCXZSUCNS-LXFSFDBISA-N |
Product Overview
Cernuine (CAS 6880-84-8), with molecular formula C16H26N2O and molecular weight 262.20 g/mol. IUPAC: (1S,7S,9R,11S,13S)-11-methyl-2,17-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-3-one.
Chemical Property Profile of Cernuine
Property Insights of Cernuine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cernuine. With a topological polar surface area (TPSA) of 23.6 Ų, Cernuine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cernuine has 0 hydrogen bond donor(s) and 2 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 Cernuine?
The CAS number of Cernuine is 6880-84-8.
What is the molecular formula of Cernuine?
The molecular formula of Cernuine is C16H26N2O.
What is the molecular weight of Cernuine?
The molecular weight of Cernuine is 262.20 g/mol.
Where can I buy Cernuine?
You can request a quote for Cernuine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cernuine?
Yes, KEHONG BIO provides custom synthesis services for Cernuine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.