4-[4-(butane-1-sulfonyl)piperazin-1-yl]-2-(2-phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Chemical Structure Depiction of
4-[4-(butane-1-sulfonyl)piperazin-1-yl]-2-(2-phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
4-[4-(butane-1-sulfonyl)piperazin-1-yl]-2-(2-phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | V001-3153 |
| Compound Name: | 4-[4-(butane-1-sulfonyl)piperazin-1-yl]-2-(2-phenylethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine |
| Molecular Weight: | 498.71 |
| Molecular Formula: | C26 H34 N4 O2 S2 |
| Salt: | not_available |
| Smiles: | CCCCS(N1CCN(CC1)c1c2c3CCCCc3sc2nc(CCc2ccccc2)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3808 |
| logD: | 5.9901 |
| logSw: | -5.8503 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.624 |
| InChI Key: | CDINRNBJFVNDSO-UHFFFAOYSA-N |