3-ethyl-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-ethyl-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
3-ethyl-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C280-1131 |
| Compound Name: | 3-ethyl-2-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 416.56 |
| Molecular Formula: | C20 H24 N4 O2 S2 |
| Smiles: | CCN1C(=NC2CCSC=2C1=O)SCC(N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1103 |
| logD: | 2.1103 |
| logSw: | -2.3327 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.757 |
| InChI Key: | QRLLVWRGAKINLY-UHFFFAOYSA-N |