1-{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazin-1-yl}-2-chloropropan-1-one
Chemical Structure Depiction of
1-{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazin-1-yl}-2-chloropropan-1-one
1-{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazin-1-yl}-2-chloropropan-1-one
Compound characteristics
| Compound ID: | V005-7215 |
| Compound Name: | 1-{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazin-1-yl}-2-chloropropan-1-one |
| Molecular Weight: | 374.83 |
| Molecular Formula: | C18 H19 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C(N1CCN(CC1)c1nccc(c2ccc3c(c2)OCO3)n1)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1542 |
| logD: | 3.1535 |
| logSw: | -3.1487 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.193 |
| InChI Key: | XHVPINVILXZODX-LBPRGKRZSA-N |