N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | P510-0635 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C22 H27 N5 O3 S |
| Smiles: | C1CN(CCC1C(Nc1ccc2c(c1)OCCO2)=O)c1cc(ncn1)N1CCSCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.6381 |
| logD: | 2.6208 |
| logSw: | -3.1022 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.795 |
| InChI Key: | OIVKIDSGYDXENT-UHFFFAOYSA-N |