1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C258-0620 |
| Compound Name: | 1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 500.62 |
| Molecular Formula: | C28 H28 N4 O3 S |
| Smiles: | C1CCc2c(C1)c1C(N(C(N(CC(N3CCN(CC3)c3ccccc3)=O)c1s2)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9047 |
| logD: | 3.9046 |
| logSw: | -4.2311 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.68 |
| InChI Key: | VPMFJUZQMNQIIW-UHFFFAOYSA-N |