4-({[2-(4-chlorophenyl)ethyl]amino}methylidene)-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-({[2-(4-chlorophenyl)ethyl]amino}methylidene)-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
4-({[2-(4-chlorophenyl)ethyl]amino}methylidene)-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8012-5372 |
| Compound Name: | 4-({[2-(4-chlorophenyl)ethyl]amino}methylidene)-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 385.87 |
| Molecular Formula: | C21 H21 Cl F N3 O |
| Smiles: | CCCC1\C(=C/NCCc2ccc(cc2)[Cl])C(N(c2ccc(cc2)F)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0528 |
| logD: | 4.0415 |
| logSw: | -4.3786 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.291 |
| InChI Key: | AMSKBYOIKZZYDS-UHFFFAOYSA-N |