4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]-N-[(furan-2-yl)methyl]piperidine-1-carboxamide
Chemical Structure Depiction of
4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]-N-[(furan-2-yl)methyl]piperidine-1-carboxamide
4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]-N-[(furan-2-yl)methyl]piperidine-1-carboxamide
Compound characteristics
| Compound ID: | S897-0101 |
| Compound Name: | 4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]-N-[(furan-2-yl)methyl]piperidine-1-carboxamide |
| Molecular Weight: | 400.48 |
| Molecular Formula: | C21 H28 N4 O4 |
| Smiles: | CCc1nc2CCOCCc2c(n1)OC1CCN(CC1)C(NCc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7377 |
| logD: | 2.7377 |
| logSw: | -2.8458 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.02 |
| InChI Key: | XKXZZALUFISCCT-UHFFFAOYSA-N |