(4-{[2-(propan-2-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
(4-{[2-(propan-2-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)(pyrrolidin-1-yl)methanone
(4-{[2-(propan-2-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | S897-1007 |
| Compound Name: | (4-{[2-(propan-2-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 388.51 |
| Molecular Formula: | C21 H32 N4 O3 |
| Smiles: | CC(C)c1nc2CCOCCc2c(n1)OC1CCN(CC1)C(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2626 |
| logD: | 3.2626 |
| logSw: | -3.3743 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.31 |
| InChI Key: | XSKZRMGPXRWXDK-UHFFFAOYSA-N |