4-{[(3-ethoxypropyl)amino]methylidene}-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[(3-ethoxypropyl)amino]methylidene}-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
4-{[(3-ethoxypropyl)amino]methylidene}-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8013-0894 |
| Compound Name: | 4-{[(3-ethoxypropyl)amino]methylidene}-2-(4-fluorophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 333.4 |
| Molecular Formula: | C18 H24 F N3 O2 |
| Smiles: | CCCC1/C(=C/NCCCOCC)C(N(c2ccc(cc2)F)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5686 |
| logD: | 2.5573 |
| logSw: | -2.8517 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.54 |
| InChI Key: | MTTKMGRVTHLHOL-UHFFFAOYSA-N |