4-({[(furan-2-yl)methyl]imino}methyl)-2-(4-nitrophenyl)-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-({[(furan-2-yl)methyl]imino}methyl)-2-(4-nitrophenyl)-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one
4-({[(furan-2-yl)methyl]imino}methyl)-2-(4-nitrophenyl)-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8007-3034 |
| Compound Name: | 4-({[(furan-2-yl)methyl]imino}methyl)-2-(4-nitrophenyl)-5-(trifluoromethyl)-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 380.28 |
| Molecular Formula: | C16 H11 F3 N4 O4 |
| Smiles: | C(c1ccco1)/N=C/C1=C(C(F)(F)F)NN(C1=O)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8258 |
| logD: | -2.7821 |
| logSw: | -3.2672 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.183 |
| InChI Key: | ZSNRFTKISJESAM-UHFFFAOYSA-N |