7-tert-butyl-2-{3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
7-tert-butyl-2-{3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
7-tert-butyl-2-{3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F145-0700 |
| Compound Name: | 7-tert-butyl-2-{3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 496.63 |
| Molecular Formula: | C26 H32 N4 O4 S |
| Smiles: | CC(C)(C)C1CCc2c3C(NC(CCC(N4CCN(CC4)C(c4ccco4)=O)=O)=Nc3sc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2641 |
| logD: | 3.2635 |
| logSw: | -3.5331 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.15 |
| InChI Key: | ZEXXQMHYDLMVRE-MRXNPFEDSA-N |