2-{3-[4-(4-acetylphenyl)piperazin-1-yl]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{3-[4-(4-acetylphenyl)piperazin-1-yl]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-{3-[4-(4-acetylphenyl)piperazin-1-yl]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C173-0182 |
| Compound Name: | 2-{3-[4-(4-acetylphenyl)piperazin-1-yl]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 464.59 |
| Molecular Formula: | C25 H28 N4 O3 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(CCC1NC(c2c3CCCCc3sc2N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7976 |
| logD: | 2.797 |
| logSw: | -3.4751 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.203 |
| InChI Key: | JLBVXAUDURCKSZ-UHFFFAOYSA-N |