TL;DR: (2,6-difluorophenyl)hydrazine (CAS 119457-22-6) is a chemical compound with molecular formula C28H21ClN6O2 and molecular weight 508.14145 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4Z)-4-[1-(4-aminophenyl)ethylidene]-2-[2-(2-chloroindolo[2,3-b]quinoxalin-6-yl)acetyl]-5-methylpyrazol-3-one
Also Known As: (2,6-difluorophenyl)hydrazine, 3H-Pyrazol-3-one, 2,4-dihydro-4-(1-(4-aminophenyl)ethylidene)-2-((2-chloro-6H-indolo(2,3-b)quinoxalin-6-yl)acetyl)-5-methyl-, (4Z)-4-[1-(4-aminophenyl)ethylidene]-2-[2-(2-chloroindolo[2,3-b]quinoxalin-6-yl)acetyl]-5-methylpyrazol-3-one, 4-[1-(4-aminophenyl)ethylidene]-2-[2-(2-chloroindolo[2,3-b]quinoxalin-6-yl)acetyl]-5-methylpyrazol-3-one
| Molecular Formula | C28H21ClN6O2 |
| Molecular Weight | 508.14145 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 508.14145 Da |
| Heavy Atoms | 37 |
| Complexity | 991.0 |
| SMILES | CC\1=NN(C(=O)/C1=C(/C)\C2=CC=C(C=C2)N)C(=O)CN3C4=CC=CC=C4C5=NC6=C(C=CC(=C6)Cl)N=C53 |
| InChIKey | UPCXMIBTMKUJSM-MYYYXRDXSA-N |
The XLogP value of 5.1 indicates that (2,6-difluorophenyl)hydrazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,6-difluorophenyl)hydrazine. Following Lipinski's Rule of Five, (2,6-difluorophenyl)hydrazine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (2,6-difluorophenyl)hydrazine is 119457-22-6.
The molecular formula of (2,6-difluorophenyl)hydrazine is C28H21ClN6O2.
The molecular weight of (2,6-difluorophenyl)hydrazine is 508.14145 g/mol.
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