N-(4-bromo-2,6-dimethylphenyl)-3-[(3-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2,6-dimethylphenyl)-3-[(3-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(4-bromo-2,6-dimethylphenyl)-3-[(3-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K821-0603 |
| Compound Name: | N-(4-bromo-2,6-dimethylphenyl)-3-[(3-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 500.39 |
| Molecular Formula: | C23 H19 Br F N3 O2 S |
| Smiles: | Cc1cc(cc(C)c1NC(c1c(C)c2C(N(Cc3cccc(c3)F)C=Nc2s1)=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.4134 |
| logD: | 4.2756 |
| logSw: | -4.4402 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.937 |
| InChI Key: | HPYJVXLTEPZNCW-UHFFFAOYSA-N |