AB01330964-02
TL;DR: AB01330964-02 (CAS 1212428-99-3) is a chemical compound with molecular formula C24H30FNO3 and molecular weight 399.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,4aS,8aS)-1-(3-ethoxy-4-hydroxyphenyl)-2-[(2-fluorophenyl)methyl]-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol
Also Known As: AB01330964-02, (1R,4aS,8aS)-1-(3-ethoxy-4-hydroxyphenyl)-2-(2-fluorobenzyl)decahydroisoquinolin-4a-ol, (1R,4aS,8aS)-1-(3-ethoxy-4-hydroxyphenyl)-2-(2-fluorobenzyl)octahydroisoquinolin-4a(2H)-ol, (1R,4aS,8aS)-1-(3-ethoxy-4-hydroxyphenyl)-2-[(2-fluorophenyl)methyl]-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol
| Molecular Formula | C24H30FNO3 |
|---|---|
| Molecular Weight | 399.22 g/mol |
| LogP | 4.7983 |
| Topological Polar Surface Area | 52.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.22098 |
| Heavy Atoms | 29 |
| Complexity | 857.7695 |
Chemical Identifiers
| CAS Number | 1212428-99-3 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)[C@H]2[C@@H]3CCCC[C@@]3(CCN2CC4=CC=CC=C4F)O)O |
Product Overview
AB01330964-02 (CAS 1212428-99-3), with molecular formula C24H30FNO3 and molecular weight 399.22 g/mol. IUPAC: (1R,4aS,8aS)-1-(3-ethoxy-4-hydroxyphenyl)-2-[(2-fluorophenyl)methyl]-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol.
Chemical Property Profile of AB01330964-02
Property Insights of AB01330964-02
The XLogP value of 4.7983 indicates that AB01330964-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.93 Ų, AB01330964-02 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01330964-02 has 2 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 AB01330964-02?
The CAS number of AB01330964-02 is 1212428-99-3.
What is the molecular formula of AB01330964-02?
The molecular formula of AB01330964-02 is C24H30FNO3.
What is the molecular weight of AB01330964-02?
The molecular weight of AB01330964-02 is 399.22 g/mol.
Where can I buy AB01330964-02?
You can request a quote for AB01330964-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01330964-02?
Yes, KEHONG BIO provides custom synthesis services for AB01330964-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.