2-(3-benzyl-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-(3-benzyl-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
2-(3-benzyl-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | F462-0055 |
| Compound Name: | 2-(3-benzyl-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl)-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 455.39 |
| Molecular Formula: | C22 H16 F3 N5 O3 |
| Smiles: | C(C(Nc1cccc(c1)C(F)(F)F)=O)N1C(N(Cc2ccccc2)C(c2c1nccn2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7775 |
| logD: | 3.7771 |
| logSw: | -4.1027 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.656 |
| InChI Key: | VRODTWLSOWTKKA-UHFFFAOYSA-N |