4-[4-(2-fluorophenyl)piperazin-1-yl]-N-(2-methoxy-5-nitrophenyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
4-[4-(2-fluorophenyl)piperazin-1-yl]-N-(2-methoxy-5-nitrophenyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
4-[4-(2-fluorophenyl)piperazin-1-yl]-N-(2-methoxy-5-nitrophenyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K913-0206 |
| Compound Name: | 4-[4-(2-fluorophenyl)piperazin-1-yl]-N-(2-methoxy-5-nitrophenyl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 522.56 |
| Molecular Formula: | C25 H23 F N6 O4 S |
| Smiles: | Cc1c2c(ncnc2sc1C(Nc1cc(ccc1OC)[N+]([O-])=O)=O)N1CCN(CC1)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 5.1762 |
| logD: | 4.3146 |
| logSw: | -5.2185 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.903 |
| InChI Key: | IPPPOPZMLWHGCE-UHFFFAOYSA-N |