ethyl 2-{4-[(6-methoxy-2H-1,3-benzodioxol-5-yl)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-[(6-methoxy-2H-1,3-benzodioxol-5-yl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-{4-[(6-methoxy-2H-1,3-benzodioxol-5-yl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 4823-2835 |
| Compound Name: | ethyl 2-{4-[(6-methoxy-2H-1,3-benzodioxol-5-yl)methylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 429.45 |
| Molecular Formula: | C20 H19 N3 O6 S |
| Smiles: | CCOC(c1c(C)nc(N2C(C(=C\c3cc4c(cc3OC)OCO4)\C(C)=N2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4764 |
| logD: | 3.4764 |
| logSw: | -3.7611 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.484 |
| InChI Key: | AGGSPYHTWXCJLF-UHFFFAOYSA-N |