9-fluoro-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
9-fluoro-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
9-fluoro-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C201-0911 |
| Compound Name: | 9-fluoro-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C23 H21 F N4 O3 S |
| Smiles: | COc1ccccc1N1CCN(CC1)C(CN1C=Nc2c3c(cccc3sc2C1=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8684 |
| logD: | 2.8681 |
| logSw: | -3.4394 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.816 |
| InChI Key: | PKFRDGKEOBCKAC-UHFFFAOYSA-N |