N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G821-0528 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 454.5 |
| Molecular Formula: | C22 H22 N4 O5 S |
| Smiles: | Cc1c2C(NC=Nc2sc1C(N1CCC(CC1)C(Nc1ccc2c(c1)OCCO2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2766 |
| logD: | 0.2738 |
| logSw: | -2.4059 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.4 |
| InChI Key: | OSYWUFVDLDDEAJ-UHFFFAOYSA-N |