2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N'-{[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
Chemical Structure Depiction of
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N'-{[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N'-{[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
Compound characteristics
| Compound ID: | 3254-0649 |
| Compound Name: | 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N'-{[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide |
| Molecular Weight: | 408.34 |
| Molecular Formula: | C17 H15 F3 N6 O3 |
| Smiles: | CN1C(c2c(ncn2CC(N/N=C/c2ccc(cc2)C(F)(F)F)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4459 |
| logD: | 1.4455 |
| logSw: | -2.2648 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.334 |
| InChI Key: | GJYKZROJKIHDIJ-UHFFFAOYSA-N |