F0746-0004
TL;DR: F0746-0004 (CAS 324058-52-8) is a chemical compound with molecular formula C16H15Cl5F3N3O2 and molecular weight 512.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5,6-dichloro-2-(trichloromethyl)-1,3-benzodioxol-2-yl]-1-(4-ethylpiperazin-1-yl)-2,2,2-trifluoroethanimine
Also Known As: F0746-0004, (1Z)-N-[5,6-dichloro-2-(trichloromethyl)-2H-1,3-benzodioxol-2-yl]-1-(4-ethylpiperazin-1-yl)-2,2,2-trifluoroethan-1-imine, (Z)-[1-(4-ethyl-1-piperazinyl)-2,2,2-trifluoroethylidene][5,6-dichloro-2-(trichloromethyl)-2H-1,3-benzodioxol-2-yl]amine, N-[5,6-dichloro-2-(trichloromethyl)-1,3-benzodioxol-2-yl]-1-(4-ethylpiperazin-1-yl)-2,2,2-trifluoroethanimine
| Molecular Formula | C16H15Cl5F3N3O2 |
|---|---|
| Molecular Weight | 512.96 g/mol |
| LogP | 5.3869 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 512.9559 |
| Heavy Atoms | 29 |
| Complexity | 777.2157 |
Chemical Identifiers
| CAS Number | 324058-52-8 |
|---|---|
| SMILES | CCN1CCN(CC1)C(=NC2(OC3=CC(=C(C=C3O2)Cl)Cl)C(Cl)(Cl)Cl)C(F)(F)F |
Product Overview
F0746-0004 (CAS 324058-52-8), with molecular formula C16H15Cl5F3N3O2 and molecular weight 512.96 g/mol. IUPAC: N-[5,6-dichloro-2-(trichloromethyl)-1,3-benzodioxol-2-yl]-1-(4-ethylpiperazin-1-yl)-2,2,2-trifluoroethanimine.
Chemical Property Profile of F0746-0004
Property Insights of F0746-0004
The XLogP value of 5.3869 indicates that F0746-0004 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, F0746-0004 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0746-0004 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0746-0004?
The CAS number of F0746-0004 is 324058-52-8.
What is the molecular formula of F0746-0004?
The molecular formula of F0746-0004 is C16H15Cl5F3N3O2.
What is the molecular weight of F0746-0004?
The molecular weight of F0746-0004 is 512.96 g/mol.
Where can I buy F0746-0004?
You can request a quote for F0746-0004 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0746-0004?
Yes, KEHONG BIO provides custom synthesis services for F0746-0004 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.