N-(2H-1,3-benzodioxol-5-yl)-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
Compound characteristics
Compound ID: | G887-0629 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide |
Molecular Weight: | 410.49 |
Molecular Formula: | C21 H22 N4 O3 S |
Smiles: | CCc1cc2c(ncnc2s1)N1CCC(CC1)C(Nc1ccc2c(c1)OCO2)=O |
Stereo: | ACHIRAL |
logP: | 4.1441 |
logD: | 4.1207 |
logSw: | -4.0552 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.745 |
InChI Key: | PLWJUVABFZYCRA-UHFFFAOYSA-N |