3-phenyl-2-({[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-phenyl-2-({[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-phenyl-2-({[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 7543-0795 |
| Compound Name: | 3-phenyl-2-({[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 478.61 |
| Molecular Formula: | C23 H18 N4 O2 S3 |
| Smiles: | C1CCc2c(C1)c1C(N(C(=Nc1s2)SCc1nc(c2cccs2)no1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.711 |
| logD: | 5.711 |
| logSw: | -5.7756 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.344 |
| InChI Key: | DXOWIIUMYABUOF-UHFFFAOYSA-N |