N-(4-methoxyphenyl)-4-[1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]butanamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-4-[1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]butanamide
N-(4-methoxyphenyl)-4-[1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]butanamide
Compound characteristics
| Compound ID: | C200-1175 |
| Compound Name: | N-(4-methoxyphenyl)-4-[1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]butanamide |
| Molecular Weight: | 520.61 |
| Molecular Formula: | C27 H28 N4 O5 S |
| Smiles: | Cc1ccc(CNC(CN2C(N(CCCC(Nc3ccc(cc3)OC)=O)C(c3c2ccs3)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2463 |
| logD: | 3.2463 |
| logSw: | -3.6174 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.428 |
| InChI Key: | LGSCDZKCVDZFTQ-UHFFFAOYSA-N |