2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-3-(2-phenylethyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-3-(2-phenylethyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-3-(2-phenylethyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | E580-0135 |
| Compound Name: | 2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-3-(2-phenylethyl)-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 492.66 |
| Molecular Formula: | C26 H28 N4 O2 S2 |
| Smiles: | C1CSC2=C1N=C(N(CCc1ccccc1)C2=O)SCC(N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5115 |
| logD: | 3.5114 |
| logSw: | -3.5862 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.739 |
| InChI Key: | PVSJSJJZZSHCQG-UHFFFAOYSA-N |