2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]-1-[4-(pyrimidin-2-yl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]-1-[4-(pyrimidin-2-yl)-1,4-diazepan-1-yl]ethan-1-one
2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]-1-[4-(pyrimidin-2-yl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | T428-0177 |
| Compound Name: | 2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]-1-[4-(pyrimidin-2-yl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 411.51 |
| Molecular Formula: | C21 H29 N7 O2 |
| Smiles: | COc1nccc(n1)N1CCC(CC1)CC(N1CCCN(CC1)c1ncccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7998 |
| logD: | 2.7998 |
| logSw: | -2.8814 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.577 |
| InChI Key: | JHORULBASDFDRM-UHFFFAOYSA-N |