ethyl 4-({1-[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-propyl-1H-pyrazol-4-yl]ethylidene}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({1-[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-propyl-1H-pyrazol-4-yl]ethylidene}amino)benzoate
ethyl 4-({1-[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-propyl-1H-pyrazol-4-yl]ethylidene}amino)benzoate
Compound characteristics
| Compound ID: | 5236-0001 |
| Compound Name: | ethyl 4-({1-[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-propyl-1H-pyrazol-4-yl]ethylidene}amino)benzoate |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C24 H24 N4 O3 S |
| Smiles: | CCCc1c(C(/C)=N/c2ccc(cc2)C(=O)OCC)c(n(c2nc3ccccc3s2)n1)O |
| Stereo: | ACHIRAL |
| logP: | 5.5983 |
| logD: | 3.9304 |
| logSw: | -5.4475 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.523 |
| InChI Key: | HGXDURJPDXWHMU-UHFFFAOYSA-N |