N-(2-bromo-4,6-difluorophenyl)-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-bromo-4,6-difluorophenyl)-5-methyl-4-oxo-3-[2-oxo-2-(piperidin-1-yl)ethyl]-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(2-bromo-4,6-difluorophenyl)-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: | K847-0424 |
| Compound Name: | N-(2-bromo-4,6-difluorophenyl)-5-methyl-4-oxo-3-[2-oxo-2-(piperidin-1-yl)ethyl]-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 525.37 |
| Molecular Formula: | C21 H19 Br F2 N4 O3 S |
| Smiles: | Cc1c2C(N(CC(N3CCCCC3)=O)C=Nc2sc1C(Nc1c(cc(cc1[Br])F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4403 |
| logD: | 0.4797 |
| logSw: | -2.8755 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.329 |
| InChI Key: | HZBNCISIODREMV-UHFFFAOYSA-N |