2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-N-[2-(trifluoromethoxy)phenyl]acetamide
Chemical Structure Depiction of
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-N-[2-(trifluoromethoxy)phenyl]acetamide
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-N-[2-(trifluoromethoxy)phenyl]acetamide
Compound characteristics
| Compound ID: | D283-0044 |
| Compound Name: | 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-N-[2-(trifluoromethoxy)phenyl]acetamide |
| Molecular Weight: | 397.31 |
| Molecular Formula: | C16 H14 F3 N5 O4 |
| Smiles: | CN1C(c2c(N(C)C1=O)n(CC(Nc1ccccc1OC(F)(F)F)=O)cn2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0951 |
| logD: | 2.0734 |
| logSw: | -2.8447 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.379 |
| InChI Key: | LFSHWDWQDQIALZ-UHFFFAOYSA-N |