N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazine-1-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | D430-2388 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazine-1-carboxamide |
| Molecular Weight: | 460.54 |
| Molecular Formula: | C25 H28 N6 O3 |
| Smiles: | Cc1ccc(cc1)Nc1cc(nc(C)n1)N1CCN(CC1)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7605 |
| logD: | 3.2444 |
| logSw: | -3.8275 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.918 |
| InChI Key: | YGETXWACYMYMTG-UHFFFAOYSA-N |