N-(4-bromo-2-methylphenyl)-5-methyl-4-oxo-3-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-5-methyl-4-oxo-3-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(4-bromo-2-methylphenyl)-5-methyl-4-oxo-3-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K892-0156 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-5-methyl-4-oxo-3-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 579.39 |
| Molecular Formula: | C24 H18 Br F3 N4 O3 S |
| Smiles: | Cc1cc(ccc1NC(c1c(C)c2C(N(CC(Nc3cccc(c3)C(F)(F)F)=O)C=Nc2s1)=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.2623 |
| logD: | 5.1776 |
| logSw: | -5.2977 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.784 |
| InChI Key: | ATNYBVPJUIUXIL-UHFFFAOYSA-N |