2-(3-methoxyphenyl)-1-(4-{[2-(propan-2-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-(3-methoxyphenyl)-1-(4-{[2-(propan-2-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)ethan-1-one
2-(3-methoxyphenyl)-1-(4-{[2-(propan-2-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | S897-0905 |
| Compound Name: | 2-(3-methoxyphenyl)-1-(4-{[2-(propan-2-yl)-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl]oxy}piperidin-1-yl)ethan-1-one |
| Molecular Weight: | 439.55 |
| Molecular Formula: | C25 H33 N3 O4 |
| Smiles: | CC(C)c1nc2CCOCCc2c(n1)OC1CCN(CC1)C(Cc1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8312 |
| logD: | 3.8312 |
| logSw: | -4.1787 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.154 |
| InChI Key: | YDYGLGBBWUISTI-UHFFFAOYSA-N |