AO-080/42479767
TL;DR: AO-080/42479767 (CAS 1049982-76-4) is a chemical compound with molecular formula C20H19ClF2N2O and molecular weight 376.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-4,5-difluorophenyl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone
Also Known As: AO-080/42479767, 1-(2-chloro-4,5-difluorobenzoyl)-4-cinnamylpiperazine, (2-chloro-4,5-difluorophenyl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone
| Molecular Formula | C20H19ClF2N2O |
|---|---|
| Molecular Weight | 376.12 g/mol |
| LogP | 4.0894 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 376.1154 |
| Heavy Atoms | 26 |
| Complexity | 802.9585 |
Chemical Identifiers
| CAS Number | 1049982-76-4 |
|---|---|
| SMILES | C1CN(CCN1C/C=C/C2=CC=CC=C2)C(=O)C3=CC(=C(C=C3Cl)F)F |
Product Overview
AO-080/42479767 (CAS 1049982-76-4), with molecular formula C20H19ClF2N2O and molecular weight 376.12 g/mol. IUPAC: (2-chloro-4,5-difluorophenyl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone.
Chemical Property Profile of AO-080/42479767
Property Insights of AO-080/42479767
The XLogP value of 4.0894 indicates that AO-080/42479767 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.55 Ų, AO-080/42479767 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-080/42479767 has 0 hydrogen bond donor(s) and 2 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 AO-080/42479767?
The CAS number of AO-080/42479767 is 1049982-76-4.
What is the molecular formula of AO-080/42479767?
The molecular formula of AO-080/42479767 is C20H19ClF2N2O.
What is the molecular weight of AO-080/42479767?
The molecular weight of AO-080/42479767 is 376.12 g/mol.
Where can I buy AO-080/42479767?
You can request a quote for AO-080/42479767 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-080/42479767?
Yes, KEHONG BIO provides custom synthesis services for AO-080/42479767 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.