2-(4-bromothiophen-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-bromothiophen-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-(4-bromothiophen-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y500-7174 |
| Compound Name: | 2-(4-bromothiophen-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 367.28 |
| Molecular Formula: | C14 H11 Br N2 O S2 |
| Smiles: | C1CCc2c(C1)c1C(NC(c3cc(cs3)[Br])=Nc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3074 |
| logD: | 3.9964 |
| logSw: | -4.3961 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.732 |
| InChI Key: | QCZMIOFSFPVDKG-UHFFFAOYSA-N |