A2021/0084825
TL;DR: A2021/0084825 (CAS 5653-53-2) is a chemical compound with molecular formula C19H10F7N3O4 and molecular weight 477.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5,6-tetrafluoro-N-[(E)-[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylideneamino]-4-(trifluoromethyl)aniline
Also Known As: A2021/0084825, (1E)-1-{[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylidene}-2-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]hydrazine, 2,3,5,6-tetrafluoro-N-[(E)-[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylideneamino]-4-(trifluoromethyl)aniline, {(1E)-2-[5-(2-methoxy-5-nitrophenyl)(2-furyl)]-1-azavinyl}[2,3,5,6-tetrafluoro -4-(trifluoromethyl)phenyl]amine, 5-(2-methoxy-5-nitrophenyl)-2-furaldehyde [2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]hydrazone
| Molecular Formula | C19H10F7N3O4 |
|---|---|
| Molecular Weight | 477.06 g/mol |
| LogP | 5.8846 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 477.05594 |
| Heavy Atoms | 33 |
| Complexity | 1225.9089 |
Chemical Identifiers
| CAS Number | 5653-53-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)[N+](=O)[O-])C2=CC=C(O2)/C=N/NC3=C(C(=C(C(=C3F)F)C(F)(F)F)F)F |
Product Overview
A2021/0084825 (CAS 5653-53-2), with molecular formula C19H10F7N3O4 and molecular weight 477.06 g/mol. IUPAC: 2,3,5,6-tetrafluoro-N-[(E)-[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylideneamino]-4-(trifluoromethyl)aniline.
Chemical Property Profile of A2021/0084825
Property Insights of A2021/0084825
The XLogP value of 5.8846 indicates that A2021/0084825 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for A2021/0084825. Following Lipinski's Rule of Five, A2021/0084825 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2021/0084825?
The CAS number of A2021/0084825 is 5653-53-2.
What is the molecular formula of A2021/0084825?
The molecular formula of A2021/0084825 is C19H10F7N3O4.
What is the molecular weight of A2021/0084825?
The molecular weight of A2021/0084825 is 477.06 g/mol.
Where can I buy A2021/0084825?
You can request a quote for A2021/0084825 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2021/0084825?
Yes, KEHONG BIO provides custom synthesis services for A2021/0084825 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.