ethyl 4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-8-carboxylate
Chemical Structure Depiction of
ethyl 4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-8-carboxylate
ethyl 4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-8-carboxylate
Compound characteristics
| Compound ID: | E616-1038 |
| Compound Name: | ethyl 4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-8-carboxylate |
| Molecular Weight: | 416.43 |
| Molecular Formula: | C21 H24 N2 O7 |
| Smiles: | CCOC(N1CCC2(CC1)C(=C(C)C(=O)O2)C(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0607 |
| logD: | 2.0607 |
| logSw: | -2.7631 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.373 |
| InChI Key: | IMBRHHLDMOJCKA-UHFFFAOYSA-N |