N-benzyl-4-{1-[(2,5-dimethylphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}butanamide
Chemical Structure Depiction of
N-benzyl-4-{1-[(2,5-dimethylphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}butanamide
N-benzyl-4-{1-[(2,5-dimethylphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}butanamide
Compound characteristics
| Compound ID: | C241-2107 |
| Compound Name: | N-benzyl-4-{1-[(2,5-dimethylphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}butanamide |
| Molecular Weight: | 461.58 |
| Molecular Formula: | C26 H27 N3 O3 S |
| Smiles: | Cc1ccc(C)c(CN2C(N(CCCC(NCc3ccccc3)=O)C(c3c2ccs3)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.6032 |
| logD: | 4.6032 |
| logSw: | -4.2861 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.735 |
| InChI Key: | OPWAPOLCUCZIES-UHFFFAOYSA-N |