2-(1,3-benzothiazol-2-yl)-4-[(dimethylamino)methylidene]-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-4-[(dimethylamino)methylidene]-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
2-(1,3-benzothiazol-2-yl)-4-[(dimethylamino)methylidene]-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 3046-8104 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-4-[(dimethylamino)methylidene]-5-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 348.42 |
| Molecular Formula: | C19 H16 N4 O S |
| Smiles: | CN(C)/C=C1\C(c2ccccc2)=NN(C1=O)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.1198 |
| logD: | 3.1147 |
| logSw: | -3.1508 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.446 |
| InChI Key: | PUDJRTYBFCAPOY-UHFFFAOYSA-N |