2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Chemical Structure Depiction of
2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide
2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Compound characteristics
| Compound ID: | K292-0433 |
| Compound Name: | 2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide |
| Molecular Weight: | 477.36 |
| Molecular Formula: | C18 H13 Br N4 O3 S2 |
| Smiles: | Cc1cc(NC(CSC2=Nc3ccsc3C(N2c2ccc(cc2)[Br])=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.1192 |
| logD: | 4.11 |
| logSw: | -4.2527 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.123 |
| InChI Key: | XVVORUIBSRRURO-UHFFFAOYSA-N |