2-{3-[3-methyl-4-(4-methylphenyl)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-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-{3-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C200-8270 |
| Compound Name: | 2-{3-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-3-oxopropyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 450.6 |
| Molecular Formula: | C25 H30 N4 O2 S |
| Smiles: | CC1CN(CCN1c1ccc(C)cc1)C(CCC1NC(c2c3CCCCc3sc2N=1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9033 |
| logD: | 3.9017 |
| logSw: | -4.2741 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.595 |
| InChI Key: | YSONOYZEGBOQHV-KRWDZBQOSA-N |