ethyl 4-{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}-4-oxobutanoate
Chemical Structure Depiction of
ethyl 4-{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}-4-oxobutanoate
ethyl 4-{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}-4-oxobutanoate
Compound characteristics
| Compound ID: | V031-0389 |
| Compound Name: | ethyl 4-{4-[7-methyl-2-(propan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}-4-oxobutanoate |
| Molecular Weight: | 458.62 |
| Molecular Formula: | C24 H34 N4 O3 S |
| Smiles: | CCOC(CCC(N1CCN(CC1)c1c2c3CCC(C)Cc3sc2nc(C(C)C)n1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8549 |
| logD: | 4.5026 |
| logSw: | -4.709 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.579 |
| InChI Key: | UMFFXRRJTZONIU-INIZCTEOSA-N |