9-chloro-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
9-chloro-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
9-chloro-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F464-0372 |
| Compound Name: | 9-chloro-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 456.92 |
| Molecular Formula: | C22 H18 Cl F N4 O2 S |
| Smiles: | C1CN(CCN1C(CN1C=Nc2c3c(cccc3sc2C1=O)[Cl])=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 3.5325 |
| logD: | 3.5324 |
| logSw: | -3.7594 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.486 |
| InChI Key: | OUAZUHYAARSGGA-UHFFFAOYSA-N |