4-[1-{2-[methyl(phenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(4-methylphenyl)methyl]butanamide
Chemical Structure Depiction of
4-[1-{2-[methyl(phenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(4-methylphenyl)methyl]butanamide
4-[1-{2-[methyl(phenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(4-methylphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | C241-1382 |
| Compound Name: | 4-[1-{2-[methyl(phenyl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]-N-[(4-methylphenyl)methyl]butanamide |
| Molecular Weight: | 504.61 |
| Molecular Formula: | C27 H28 N4 O4 S |
| Smiles: | Cc1ccc(CNC(CCCN2C(c3c(ccs3)N(CC(N(C)c3ccccc3)=O)C2=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5616 |
| logD: | 2.5616 |
| logSw: | -2.865 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.848 |
| InChI Key: | BZLARHOIKCYABP-UHFFFAOYSA-N |