N-(2-chloro-4-fluorophenyl)-2,5-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-fluorophenyl)-2,5-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
N-(2-chloro-4-fluorophenyl)-2,5-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K823-2422 |
| Compound Name: | N-(2-chloro-4-fluorophenyl)-2,5-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 433.93 |
| Molecular Formula: | C20 H21 Cl F N5 O S |
| Smiles: | Cc1c2c(nc(C)nc2sc1C(Nc1ccc(cc1[Cl])F)=O)N1CCN(C)CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.2732 |
| logD: | 4.2732 |
| logSw: | -4.4926 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.783 |
| InChI Key: | RTHPXRVRZHCZIA-UHFFFAOYSA-N |