Dihydrolusitanine
TL;DR: Dihydrolusitanine (CAS 5121-37-9) is a chemical compound with molecular formula C12H22N2O and molecular weight 210.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl)acetamide
Also Known As: Dihydrolusitanine, TimTec1_000679, N-octahydroquinolizin-1-ylmethyl-acetamide, N-[(6-azabicyclo[4.4.0]dec-2-yl)methyl]acetamide, BRD-A10386167-001-01-5
| Molecular Formula | C12H22N2O |
|---|---|
| Molecular Weight | 210.17 g/mol |
| LogP | 1.387 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.17322 |
| Heavy Atoms | 15 |
| Complexity | 227.662 |
Chemical Identifiers
| CAS Number | 5121-37-9 |
|---|---|
| SMILES | CC(=O)NCC1CCCN2C1CCCC2 |
Product Overview
Dihydrolusitanine (CAS 5121-37-9), with molecular formula C12H22N2O and molecular weight 210.17 g/mol. IUPAC: N-(2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl)acetamide.
Chemical Property Profile of Dihydrolusitanine
Property Insights of Dihydrolusitanine
The XLogP value of 1.387 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dihydrolusitanine. With a topological polar surface area (TPSA) of 32.34 Ų, Dihydrolusitanine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihydrolusitanine 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 Dihydrolusitanine?
The CAS number of Dihydrolusitanine is 5121-37-9.
What is the molecular formula of Dihydrolusitanine?
The molecular formula of Dihydrolusitanine is C12H22N2O.
What is the molecular weight of Dihydrolusitanine?
The molecular weight of Dihydrolusitanine is 210.17 g/mol.
Where can I buy Dihydrolusitanine?
You can request a quote for Dihydrolusitanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydrolusitanine?
Yes, KEHONG BIO provides custom synthesis services for Dihydrolusitanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.