N-(2-chloro-4-fluorophenyl)-5-methyl-4-oxo-3-[2-oxo-2-(piperidin-1-yl)ethyl]-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-fluorophenyl)-5-methyl-4-oxo-3-[2-oxo-2-(piperidin-1-yl)ethyl]-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(2-chloro-4-fluorophenyl)-5-methyl-4-oxo-3-[2-oxo-2-(piperidin-1-yl)ethyl]-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K847-0419 |
| Compound Name: | N-(2-chloro-4-fluorophenyl)-5-methyl-4-oxo-3-[2-oxo-2-(piperidin-1-yl)ethyl]-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 462.93 |
| Molecular Formula: | C21 H20 Cl F N4 O3 S |
| Smiles: | Cc1c2C(N(CC(N3CCCCC3)=O)C=Nc2sc1C(Nc1ccc(cc1[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7837 |
| logD: | 1.7606 |
| logSw: | -3.6978 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.027 |
| InChI Key: | OTYZCBHHUXBXDQ-UHFFFAOYSA-N |