N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-8-ethyl-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
Chemical Structure Depiction of
N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-8-ethyl-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-8-ethyl-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
Compound characteristics
| Compound ID: | E616-0583 |
| Compound Name: | N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-8-ethyl-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide |
| Molecular Weight: | 454.61 |
| Molecular Formula: | C26 H38 N4 O3 |
| Smiles: | CCN1CCC2(CC1)C(=C(C)C(=O)O2)C(NCCN1CCN(CC1)c1cccc(C)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9625 |
| logD: | -0.2782 |
| logSw: | -3.2937 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.798 |
| InChI Key: | FSEFHPVDUHMDAF-UHFFFAOYSA-N |