3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide
TL;DR: 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide (CAS 956236-88-7) is a chemical compound with molecular formula C20H27Cl3N2O2 and molecular weight 432.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methoxy]-2,2,2-trichloroethyl]-3-methylbenzamide
Also Known As: 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide, 3-methyl-N-{2,2,2-trichloro-1-[(1R,9aR)-octahydro-2H-quinolizin-1-ylmethoxy]ethyl}benzamide, N-[1-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methoxy]-2,2,2-trichloroethyl]-3-methylbenzamide
| Molecular Formula | C20H27Cl3N2O2 |
|---|---|
| Molecular Weight | 432.11 g/mol |
| LogP | 4.70222 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.1138 |
| Heavy Atoms | 27 |
| Complexity | 648.35913 |
Chemical Identifiers
| CAS Number | 956236-88-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC(C(Cl)(Cl)Cl)OC[C@@H]2CCCN3[C@@H]2CCCC3 |
Product Overview
3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide (CAS 956236-88-7), with molecular formula C20H27Cl3N2O2 and molecular weight 432.11 g/mol. IUPAC: N-[1-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methoxy]-2,2,2-trichloroethyl]-3-methylbenzamide.
Chemical Property Profile of 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide
Property Insights of 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide
The XLogP value of 4.70222 indicates that 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide has 1 hydrogen bond donor(s) and 3 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 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide?
The CAS number of 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide is 956236-88-7.
What is the molecular formula of 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide?
The molecular formula of 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide is C20H27Cl3N2O2.
What is the molecular weight of 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide?
The molecular weight of 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide is 432.11 g/mol.
Where can I buy 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide?
You can request a quote for 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-N-(2,2,2-trichloro-1-(((1R,9aR)-octahydro-1H-quinolizin-1-yl)methoxy)ethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.