N-(3-chloro-4-fluorophenyl)-2,5-dimethyl-4-[4-(pyridin-2-yl)piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2,5-dimethyl-4-[4-(pyridin-2-yl)piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxamide
N-(3-chloro-4-fluorophenyl)-2,5-dimethyl-4-[4-(pyridin-2-yl)piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K823-1976 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2,5-dimethyl-4-[4-(pyridin-2-yl)piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 496.99 |
| Molecular Formula: | C24 H22 Cl F N6 O S |
| Smiles: | Cc1c2c(nc(C)nc2sc1C(Nc1ccc(c(c1)[Cl])F)=O)N1CCN(CC1)c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 5.8568 |
| logD: | 5.3068 |
| logSw: | -6.0442 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.776 |
| InChI Key: | FCLTZNWYJPLWRY-UHFFFAOYSA-N |