ethyl 2-(4-{[4-(2-methoxy-2-oxoethoxy)phenyl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-{[4-(2-methoxy-2-oxoethoxy)phenyl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-(4-{[4-(2-methoxy-2-oxoethoxy)phenyl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 4823-2830 |
| Compound Name: | ethyl 2-(4-{[4-(2-methoxy-2-oxoethoxy)phenyl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 443.48 |
| Molecular Formula: | C21 H21 N3 O6 S |
| Smiles: | CCOC(c1c(C)nc(N2C(C(=C\c3ccc(cc3)OCC(=O)OC)\C(C)=N2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0824 |
| logD: | 3.0824 |
| logSw: | -3.2082 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.816 |
| InChI Key: | AKBGLCIGQGUMLW-UHFFFAOYSA-N |