((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate
TL;DR: ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate (CAS 307945-00-2) is a chemical compound with molecular formula C18H25NO3 and molecular weight 303.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl 2-methoxybenzoate
Also Known As: ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate, [(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl 2-methoxybenzoate
| Molecular Formula | C18H25NO3 |
|---|---|
| Molecular Weight | 303.18 g/mol |
| LogP | 3.1165 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.18344 |
| Heavy Atoms | 22 |
| Complexity | 514.80865 |
Chemical Identifiers
| CAS Number | 307945-00-2 |
|---|---|
| SMILES | COC1=CC=CC=C1C(=O)OC[C@@H]2CCCN3[C@@H]2CCCC3 |
Product Overview
((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate (CAS 307945-00-2), with molecular formula C18H25NO3 and molecular weight 303.18 g/mol. IUPAC: [(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl 2-methoxybenzoate.
Chemical Property Profile of ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate
Property Insights of ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate
The XLogP value of 3.1165 indicates that ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate has 0 hydrogen bond donor(s) and 4 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 ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate?
The CAS number of ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate is 307945-00-2.
What is the molecular formula of ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate?
The molecular formula of ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate is C18H25NO3.
What is the molecular weight of ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate?
The molecular weight of ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate is 303.18 g/mol.
Where can I buy ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate?
You can request a quote for ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for ((1R,9aR)-octahydro-1H-quinolizin-1-yl)methyl 2-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.