2-[5-(4-bromophenyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]propanoic acid
Chemical Structure Depiction of
2-[5-(4-bromophenyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]propanoic acid
2-[5-(4-bromophenyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]propanoic acid
Compound characteristics
| Compound ID: | 6291-0650 |
| Compound Name: | 2-[5-(4-bromophenyl)-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]propanoic acid |
| Molecular Weight: | 379.23 |
| Molecular Formula: | C15 H11 Br N2 O3 S |
| Smiles: | CC(C(O)=O)N1C=Nc2c(C1=O)c(cs2)c1ccc(cc1)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.562 |
| logD: | -0.6223 |
| logSw: | -2.8205 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.156 |
| InChI Key: | OPZKRDNVHUQNAO-QMMMGPOBSA-N |