9-chloro-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
9-chloro-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
9-chloro-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C201-0945 |
| Compound Name: | 9-chloro-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 468.96 |
| Molecular Formula: | C23 H21 Cl N4 O3 S |
| Smiles: | COc1ccccc1N1CCN(CC1)C(CN1C=Nc2c3c(cccc3sc2C1=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3826 |
| logD: | 3.3822 |
| logSw: | -3.6092 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.816 |
| InChI Key: | MWECXRVKQMDYRH-UHFFFAOYSA-N |