phenyl(4-{[2-(propan-2-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)methanone
Chemical Structure Depiction of
phenyl(4-{[2-(propan-2-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)methanone
phenyl(4-{[2-(propan-2-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)methanone
Compound characteristics
| Compound ID: | S897-1028 |
| Compound Name: | phenyl(4-{[2-(propan-2-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)methanone |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C23 H29 N3 O3 |
| Smiles: | CC(C)c1nc2CCOCCc2c(n1)OC1CCN(CC1)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3459 |
| logD: | 3.3459 |
| logSw: | -3.4793 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.138 |
| InChI Key: | BAQRYBPJUQWEPN-UHFFFAOYSA-N |