N-(3-chloro-4-fluorophenyl)-2,5-dimethyl-4-(4-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2,5-dimethyl-4-(4-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
N-(3-chloro-4-fluorophenyl)-2,5-dimethyl-4-(4-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K889-0839 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2,5-dimethyl-4-(4-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 432.95 |
| Molecular Formula: | C21 H22 Cl F N4 O S |
| Smiles: | CC1CCN(CC1)c1c2c(C)c(C(Nc3ccc(c(c3)[Cl])F)=O)sc2nc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.8842 |
| logD: | 5.3343 |
| logSw: | -6.0884 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.004 |
| InChI Key: | VBJDJTUUFTYHQR-UHFFFAOYSA-N |