2-(1,3-benzothiazol-2-yl)-4-{N-[(4-fluorophenyl)methyl]ethanimidoyl}-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-4-{N-[(4-fluorophenyl)methyl]ethanimidoyl}-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
2-(1,3-benzothiazol-2-yl)-4-{N-[(4-fluorophenyl)methyl]ethanimidoyl}-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 3410-1641 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-4-{N-[(4-fluorophenyl)methyl]ethanimidoyl}-5-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C25 H19 F N4 O S |
| Smiles: | C/C(C1=C(c2ccccc2)NN(C1=O)c1nc2ccccc2s1)=N/Cc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.6722 |
| logD: | 2.3229 |
| logSw: | -5.5261 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.63 |
| InChI Key: | HGMLPDPARCTNCY-UHFFFAOYSA-N |