2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-ethyl-3-phenylthieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-ethyl-3-phenylthieno[2,3-d]pyrimidin-4(3H)-one
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-ethyl-3-phenylthieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4469-0554 |
| Compound Name: | 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-ethyl-3-phenylthieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 485.42 |
| Molecular Formula: | C22 H17 Br N2 O2 S2 |
| Smiles: | CCc1cc2C(N(C(=Nc2s1)SCC(c1ccc(cc1)[Br])=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4987 |
| logD: | 5.4987 |
| logSw: | -5.4528 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.309 |
| InChI Key: | JGRGSKSDVHTNKN-UHFFFAOYSA-N |