N-{2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]phenyl}-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]phenyl}-4-(trifluoromethyl)benzamide
N-{2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]phenyl}-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | 8014-9735 |
| Compound Name: | N-{2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]phenyl}-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 500.44 |
| Molecular Formula: | C23 H19 F3 N6 O4 |
| Smiles: | CN1C(c2c(ncn2CC(Nc2ccccc2NC(c2ccc(cc2)C(F)(F)F)=O)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2802 |
| logD: | 2.1055 |
| logSw: | -2.86 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.805 |
| InChI Key: | WVASZENFDIDIND-UHFFFAOYSA-N |