ethyl 4-({1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)benzoate
ethyl 4-({1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)benzoate
Compound characteristics
| Compound ID: | 3966-4533 |
| Compound Name: | ethyl 4-({1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)benzoate |
| Molecular Weight: | 482.56 |
| Molecular Formula: | C27 H22 N4 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(\C)=C1/C(c2ccccc2)=NN(C1=O)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1546 |
| logD: | 6.1467 |
| logSw: | -5.6574 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.652 |
| InChI Key: | CFXRKJQKMZYHQS-UHFFFAOYSA-N |