RefChem:1065337
TL;DR: RefChem:1065337 (CAS 23079-39-2) is a chemical compound with molecular formula C18H26ClNO2 and molecular weight 323.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,9aR)-2-phenyl-1,3,4,6,7,8,9,9a-octahydroquinolizin-2-yl] propanoate;hydrochloride
Also Known As: KST-1A2908, trans-Octahydro-2-phenyl-2H-quinolizin-2-ol propionate hydrochloride, (2r,9ar)-2-phenyloctahydro-2h-quinolizin-2-yl propanoate hydrochloride(1:1), 2H-Quinolizin-2-ol, octahydro-2-phenyl-, propionate (ester), hydrochloride, trans-, 2H-Quinolizin-2-equatorial-ol, octahydro-2-axial-phenyl-, propionate, hydrochloride
| Molecular Formula | C18H26ClNO2 |
|---|---|
| Molecular Weight | 323.17 g/mol |
| LogP | 3.9052 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.1652 |
| Heavy Atoms | 22 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 23079-39-2 |
|---|---|
| SMILES | CCC(=O)O[C@@]1(CCN2CCCC[C@@H]2C1)C3=CC=CC=C3.Cl |
| InChIKey | GNYFGQNTMNZBME-PHJLCXHGSA-N |
Product Overview
RefChem:1065337 (CAS 23079-39-2), with molecular formula C18H26ClNO2 and molecular weight 323.17 g/mol. IUPAC: [(2R,9aR)-2-phenyl-1,3,4,6,7,8,9,9a-octahydroquinolizin-2-yl] propanoate;hydrochloride.
Chemical Property Profile of RefChem:1065337
Property Insights of RefChem:1065337
The XLogP value of 3.9052 indicates that RefChem:1065337 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, RefChem:1065337 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1065337 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 RefChem:1065337?
The CAS number of RefChem:1065337 is 23079-39-2.
What is the molecular formula of RefChem:1065337?
The molecular formula of RefChem:1065337 is C18H26ClNO2.
What is the molecular weight of RefChem:1065337?
The molecular weight of RefChem:1065337 is 323.17 g/mol.
Where can I buy RefChem:1065337?
You can request a quote for RefChem:1065337 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1065337?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1065337 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.