2-{1-[2-(2,5-dichloroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{1-[2-(2,5-dichloroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methylphenyl)methyl]acetamide
2-{1-[2-(2,5-dichloroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | C241-1690 |
| Compound Name: | 2-{1-[2-(2,5-dichloroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 531.42 |
| Molecular Formula: | C24 H20 Cl2 N4 O4 S |
| Smiles: | Cc1ccc(CNC(CN2C(c3c(ccs3)N(CC(Nc3cc(ccc3[Cl])[Cl])=O)C2=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2831 |
| logD: | 4.2736 |
| logSw: | -4.4065 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.208 |
| InChI Key: | HGRNSMPWRPDBID-UHFFFAOYSA-N |