2-(3-benzyl-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl)-N-(3-chloro-4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-(3-benzyl-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl)-N-(3-chloro-4-methoxyphenyl)acetamide
2-(3-benzyl-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl)-N-(3-chloro-4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C200-4425 |
| Compound Name: | 2-(3-benzyl-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl)-N-(3-chloro-4-methoxyphenyl)acetamide |
| Molecular Weight: | 505.98 |
| Molecular Formula: | C26 H20 Cl N3 O4 S |
| Smiles: | COc1ccc(cc1[Cl])NC(CN1C(N(Cc2ccccc2)C(c2c1c1ccccc1s2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7153 |
| logD: | 5.7151 |
| logSw: | -5.9825 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.951 |
| InChI Key: | IMKKFPWGYKFXQW-UHFFFAOYSA-N |