2-(1,3-benzothiazol-2-yl)-4-[N-(4-methylphenyl)ethanimidoyl]-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-4-[N-(4-methylphenyl)ethanimidoyl]-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
2-(1,3-benzothiazol-2-yl)-4-[N-(4-methylphenyl)ethanimidoyl]-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8012-0497 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-4-[N-(4-methylphenyl)ethanimidoyl]-5-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C25 H20 N4 O S |
| Smiles: | C\C(C1=C(c2ccccc2)NN(C1=O)c1nc2ccccc2s1)=N/c1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6255 |
| logD: | 2.4116 |
| logSw: | -5.5804 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.111 |
| InChI Key: | DYWVOTBVSGBORE-UHFFFAOYSA-N |