4-[(4-ethoxy-3-methoxyphenyl)methylidene]-5-methyl-2-(1H-tetrazol-5-yl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(4-ethoxy-3-methoxyphenyl)methylidene]-5-methyl-2-(1H-tetrazol-5-yl)-2,4-dihydro-3H-pyrazol-3-one
4-[(4-ethoxy-3-methoxyphenyl)methylidene]-5-methyl-2-(1H-tetrazol-5-yl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8016-7402 |
| Compound Name: | 4-[(4-ethoxy-3-methoxyphenyl)methylidene]-5-methyl-2-(1H-tetrazol-5-yl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 328.33 |
| Molecular Formula: | C15 H16 N6 O3 |
| Smiles: | CCOc1ccc(/C=C2/C(C)=NN(C2=O)c2nnn[nH]2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.2097 |
| logD: | -0.2332 |
| logSw: | -2.1346 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.739 |
| InChI Key: | PDBKWJJTDAHEQZ-UHFFFAOYSA-N |