3-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methylthieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methylthieno[2,3-d]pyrimidin-4(3H)-one
3-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methylthieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C096-0048 |
| Compound Name: | 3-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methylthieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 640.76 |
| Molecular Formula: | C30 H33 F N6 O5 S2 |
| Smiles: | Cc1c(c2C(N(CC(N3CCN(CC3)c3ccccc3F)=O)C=Nc2s1)=O)S(N1CCN(CC1)c1ccccc1OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.684 |
| logD: | 2.684 |
| logSw: | -3.0985 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.894 |
| InChI Key: | BDORJWHXOZBYGG-UHFFFAOYSA-N |