4-(aminomethylidene)-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-(aminomethylidene)-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
4-(aminomethylidene)-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8012-6903 |
| Compound Name: | 4-(aminomethylidene)-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 247.27 |
| Molecular Formula: | C13 H14 F N3 O |
| Smiles: | CCCC1/C(=C/N)C(N(c2ccc(cc2)F)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0754 |
| logD: | 1.0559 |
| logSw: | -2.0196 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.108 |
| InChI Key: | JNLDESXIZOHMNI-UHFFFAOYSA-N |