AB01334658-02
TL;DR: AB01334658-02 (CAS 306989-55-9) is a chemical compound with molecular formula C20H21Cl2N3 and molecular weight 373.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E,E)-2-chloro-N-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-phenylprop-2-en-1-imine
Also Known As: AB01334658-02, 4-(4-chlorobenzyl)-N-[(1E,2E)-2-chloro-3-phenylprop-2-en-1-ylidene]piperazin-1-amine, (E)-2-chloro-N-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-phenylprop-2-en-1-imine, (E)-N-((E)-2-chloro-3-phenylallylidene)-4-(4-chlorobenzyl)piperazin-1-amine
| Molecular Formula | C20H21Cl2N3 |
|---|---|
| Molecular Weight | 373.11 g/mol |
| LogP | 4.7233 |
| Topological Polar Surface Area | 18.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.11127 |
| Heavy Atoms | 25 |
| Complexity | 718.36633 |
Chemical Identifiers
| CAS Number | 306989-55-9 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=C(C=C2)Cl)/N=C/C(=C\C3=CC=CC=C3)/Cl |
Product Overview
AB01334658-02 (CAS 306989-55-9), with molecular formula C20H21Cl2N3 and molecular weight 373.11 g/mol. IUPAC: (E,E)-2-chloro-N-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-phenylprop-2-en-1-imine.
Chemical Property Profile of AB01334658-02
Property Insights of AB01334658-02
The XLogP value of 4.7233 indicates that AB01334658-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.84 Ų, AB01334658-02 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01334658-02 has 0 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 AB01334658-02?
The CAS number of AB01334658-02 is 306989-55-9.
What is the molecular formula of AB01334658-02?
The molecular formula of AB01334658-02 is C20H21Cl2N3.
What is the molecular weight of AB01334658-02?
The molecular weight of AB01334658-02 is 373.11 g/mol.
Where can I buy AB01334658-02?
You can request a quote for AB01334658-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01334658-02?
Yes, KEHONG BIO provides custom synthesis services for AB01334658-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.