N-benzyl-N,5-dimethyl-4-oxo-3-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-N,5-dimethyl-4-oxo-3-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-benzyl-N,5-dimethyl-4-oxo-3-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K823-2654 |
| Compound Name: | N-benzyl-N,5-dimethyl-4-oxo-3-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 516.62 |
| Molecular Formula: | C27 H28 N6 O3 S |
| Smiles: | Cc1c2C(N(CC(N3CCN(CC3)c3ccccn3)=O)C=Nc2sc1C(N(C)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.577 |
| logD: | 2.5682 |
| logSw: | -2.6133 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.556 |
| InChI Key: | KZSDNIQHWBIIFP-UHFFFAOYSA-N |