2-(3-benzyl-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-(3-benzyl-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
2-(3-benzyl-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | F462-0059 |
| Compound Name: | 2-(3-benzyl-2,4-dioxo-3,4-dihydropteridin-1(2H)-yl)-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 489.84 |
| Molecular Formula: | C22 H15 Cl F3 N5 O3 |
| Smiles: | C(C(Nc1cc(ccc1[Cl])C(F)(F)F)=O)N1C(N(Cc2ccccc2)C(c2c1nccn2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9592 |
| logD: | 3.933 |
| logSw: | -4.4461 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.958 |
| InChI Key: | URWNLPYAGVMHDP-UHFFFAOYSA-N |