4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]-N-(2-phenylethyl)piperidine-1-carboxamide
Chemical Structure Depiction of
4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]-N-(2-phenylethyl)piperidine-1-carboxamide
4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]-N-(2-phenylethyl)piperidine-1-carboxamide
Compound characteristics
| Compound ID: | S897-0100 |
| Compound Name: | 4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]-N-(2-phenylethyl)piperidine-1-carboxamide |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C24 H32 N4 O3 |
| Smiles: | CCc1nc2CCOCCc2c(n1)OC1CCN(CC1)C(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4036 |
| logD: | 3.4036 |
| logSw: | -3.5206 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.113 |
| InChI Key: | AIYFGBVUFXUFPG-UHFFFAOYSA-N |