ethyl 2-{[(4,4-dimethyl-2,6-dioxocyclohexyl)methylidene]amino}-5-ethylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[(4,4-dimethyl-2,6-dioxocyclohexyl)methylidene]amino}-5-ethylthiophene-3-carboxylate
ethyl 2-{[(4,4-dimethyl-2,6-dioxocyclohexyl)methylidene]amino}-5-ethylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4673-0415 |
| Compound Name: | ethyl 2-{[(4,4-dimethyl-2,6-dioxocyclohexyl)methylidene]amino}-5-ethylthiophene-3-carboxylate |
| Molecular Weight: | 349.45 |
| Molecular Formula: | C18 H23 N O4 S |
| Smiles: | CCc1cc(C(=O)OCC)c(/N=C/C2C(CC(C)(C)CC2=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.0312 |
| logD: | 1.3686 |
| logSw: | -3.1457 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.602 |
| InChI Key: | OXSXZGSVQWAQGJ-UHFFFAOYSA-N |