N-(4-bromo-3-methylphenyl)-2-(2-methyl-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-2-(2-methyl-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
N-(4-bromo-3-methylphenyl)-2-(2-methyl-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide
Compound characteristics
| Compound ID: | F464-0451 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-2-(2-methyl-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)acetamide |
| Molecular Weight: | 442.33 |
| Molecular Formula: | C20 H16 Br N3 O2 S |
| Smiles: | CC1=Nc2c3ccccc3sc2C(N1CC(Nc1ccc(c(C)c1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7064 |
| logD: | 4.7063 |
| logSw: | -4.5466 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.03 |
| InChI Key: | PRJFSMVCHDEAOX-UHFFFAOYSA-N |