4-[(cycloheptylamino)methylidene]-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(cycloheptylamino)methylidene]-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
4-[(cycloheptylamino)methylidene]-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8012-5170 |
| Compound Name: | 4-[(cycloheptylamino)methylidene]-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 343.44 |
| Molecular Formula: | C20 H26 F N3 O |
| Smiles: | CCCC1\C(=C/NC2CCCCCC2)C(N(c2ccc(cc2)F)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7812 |
| logD: | 4.7603 |
| logSw: | -4.4607 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.297 |
| InChI Key: | OCKYZZPYLYELHG-UHFFFAOYSA-N |