2-(3-benzyl-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)-N-(2-chloro-4-methylphenyl)acetamide
Chemical Structure Depiction of
2-(3-benzyl-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)-N-(2-chloro-4-methylphenyl)acetamide
2-(3-benzyl-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)-N-(2-chloro-4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | C242-1082 |
| Compound Name: | 2-(3-benzyl-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)-N-(2-chloro-4-methylphenyl)acetamide |
| Molecular Weight: | 467.97 |
| Molecular Formula: | C24 H22 Cl N3 O3 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(CN1C(N(Cc2ccccc2)C(c2c(C)c(C)sc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4289 |
| logD: | 5.4288 |
| logSw: | -6.0799 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.17 |
| InChI Key: | QELAGWUWKYMIAT-UHFFFAOYSA-N |