1-{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}-3-phenylprop-2-en-1-one
Chemical Structure Depiction of
1-{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}-3-phenylprop-2-en-1-one
1-{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}-3-phenylprop-2-en-1-one
Compound characteristics
| Compound ID: | V013-7789 |
| Compound Name: | 1-{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}-3-phenylprop-2-en-1-one |
| Molecular Weight: | 460.64 |
| Molecular Formula: | C27 H32 N4 O S |
| Salt: | not_available |
| Smiles: | CC1CCc2c3c(nc(C(C)C)nc3sc2C1)N1CCN(CC1)C(/C=C/c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5571 |
| logD: | 6.2047 |
| logSw: | -5.9574 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.149 |
| InChI Key: | ZZDCKPLGAPAZTN-LJQANCHMSA-N |