(2H-1,3-benzodioxol-5-yl){4-[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl){4-[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl}methanone
(2H-1,3-benzodioxol-5-yl){4-[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | D430-0159 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl){4-[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl}methanone |
| Molecular Weight: | 409.49 |
| Molecular Formula: | C22 H27 N5 O3 |
| Smiles: | Cc1nc(cc(n1)N1CCN(CC1)C(c1ccc2c(c1)OCO2)=O)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.6444 |
| logD: | 3.6175 |
| logSw: | -3.732 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.826 |
| InChI Key: | PHGQGEXKTFHNHF-UHFFFAOYSA-N |