Lusitanine
TL;DR: Lusitanine (CAS 5121-36-8) is a chemical compound with molecular formula C12H20N2O and molecular weight 208.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[(9aR)-2,3,4,6,7,8,9,9a-octahydroquinolizin-1-ylidene]methyl]acetamide
Also Known As: Lusitanine, Lusitanin, (-)-Lusitanine, N-[(E)-[(9aR)-2,3,4,6,7,8,9,9a-octahydroquinolizin-1-ylidene]methyl]acetamide, Acetamide, N-((hexahydro-2H-quinolizin-1(6H)-ylidene)methyl)-, (R-(E))-
| Molecular Formula | C12H20N2O |
|---|---|
| Molecular Weight | 208.16 g/mol |
| LogP | 1.6547 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.15756 |
| Heavy Atoms | 15 |
| Complexity | 270.7957 |
Chemical Identifiers
| CAS Number | 5121-36-8 |
|---|---|
| SMILES | CC(=O)N/C=C/1\CCCN2[C@@H]1CCCC2 |
Product Overview
Lusitanine (CAS 5121-36-8), with molecular formula C12H20N2O and molecular weight 208.16 g/mol. IUPAC: N-[(E)-[(9aR)-2,3,4,6,7,8,9,9a-octahydroquinolizin-1-ylidene]methyl]acetamide.
Chemical Property Profile of Lusitanine
Property Insights of Lusitanine
The XLogP value of 1.6547 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lusitanine. With a topological polar surface area (TPSA) of 32.34 Ų, Lusitanine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lusitanine has 1 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 Lusitanine?
The CAS number of Lusitanine is 5121-36-8.
What is the molecular formula of Lusitanine?
The molecular formula of Lusitanine is C12H20N2O.
What is the molecular weight of Lusitanine?
The molecular weight of Lusitanine is 208.16 g/mol.
Where can I buy Lusitanine?
You can request a quote for Lusitanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lusitanine?
Yes, KEHONG BIO provides custom synthesis services for Lusitanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.