ethyl 4-{[2-(azepan-1-yl)ethyl]carbamoyl}-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-8-carboxylate
Chemical Structure Depiction of
ethyl 4-{[2-(azepan-1-yl)ethyl]carbamoyl}-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-8-carboxylate
ethyl 4-{[2-(azepan-1-yl)ethyl]carbamoyl}-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-8-carboxylate
Compound characteristics
| Compound ID: | E616-1150 |
| Compound Name: | ethyl 4-{[2-(azepan-1-yl)ethyl]carbamoyl}-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-8-carboxylate |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C21 H33 N3 O5 |
| Smiles: | CCOC(N1CCC2(CC1)C(=C(C)C(=O)O2)C(NCCN1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8228 |
| logD: | -0.6219 |
| logSw: | -1.8267 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.412 |
| InChI Key: | RDWXZDUGCPDGQZ-UHFFFAOYSA-N |