4-(aminomethylidene)-2-(1,3-benzothiazol-2-yl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-(aminomethylidene)-2-(1,3-benzothiazol-2-yl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-(aminomethylidene)-2-(1,3-benzothiazol-2-yl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 3966-4634 |
| Compound Name: | 4-(aminomethylidene)-2-(1,3-benzothiazol-2-yl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 320.37 |
| Molecular Formula: | C17 H12 N4 O S |
| Smiles: | C(=C1\C(c2ccccc2)=NN(C1=O)c1nc2ccccc2s1)\N |
| Stereo: | ACHIRAL |
| logP: | 2.1103 |
| logD: | 2.1 |
| logSw: | -2.5019 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.468 |
| InChI Key: | NSGXUYSLMCEETC-UHFFFAOYSA-N |