AB00110898-01
TL;DR: AB00110898-01 (CAS 429637-99-0) is a chemical compound with molecular formula C25H32FN3O3 and molecular weight 441.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[(3-ethoxy-2-hydroxyphenyl)methyl]piperidin-4-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone
Also Known As: AB00110898-01, [1-(3-ethoxy-2-hydroxybenzyl)piperidin-4-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone, [1-[(3-ethoxy-2-hydroxyphenyl)methyl]piperidin-4-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone, [1-[(3-ethoxy-2-hydroxy-phenyl)methyl]-4-piperidyl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone
| Molecular Formula | C25H32FN3O3 |
|---|---|
| Molecular Weight | 441.24 g/mol |
| LogP | 3.4908 |
| Topological Polar Surface Area | 56.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 441.24277 |
| Heavy Atoms | 32 |
| Complexity | 922.3982 |
Chemical Identifiers
| CAS Number | 429637-99-0 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1O)CN2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=CC=C4F |
Product Overview
AB00110898-01 (CAS 429637-99-0), with molecular formula C25H32FN3O3 and molecular weight 441.24 g/mol. IUPAC: [1-[(3-ethoxy-2-hydroxyphenyl)methyl]piperidin-4-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone.
Chemical Property Profile of AB00110898-01
Property Insights of AB00110898-01
The XLogP value of 3.4908 indicates that AB00110898-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.25 Ų, AB00110898-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00110898-01 has 1 hydrogen bond donor(s) and 5 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 AB00110898-01?
The CAS number of AB00110898-01 is 429637-99-0.
What is the molecular formula of AB00110898-01?
The molecular formula of AB00110898-01 is C25H32FN3O3.
What is the molecular weight of AB00110898-01?
The molecular weight of AB00110898-01 is 441.24 g/mol.
Where can I buy AB00110898-01?
You can request a quote for AB00110898-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00110898-01?
Yes, KEHONG BIO provides custom synthesis services for AB00110898-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.