6,8-dimethyl-N,9-bis[3-(trifluoromethyl)phenyl]-9H-purin-2-amine
Chemical Structure Depiction of
6,8-dimethyl-N,9-bis[3-(trifluoromethyl)phenyl]-9H-purin-2-amine
6,8-dimethyl-N,9-bis[3-(trifluoromethyl)phenyl]-9H-purin-2-amine
Compound characteristics
| Compound ID: | C301-9379 |
| Compound Name: | 6,8-dimethyl-N,9-bis[3-(trifluoromethyl)phenyl]-9H-purin-2-amine |
| Molecular Weight: | 451.37 |
| Molecular Formula: | C21 H15 F6 N5 |
| Smiles: | Cc1c2c(nc(Nc3cccc(c3)C(F)(F)F)n1)n(c1cccc(c1)C(F)(F)F)c(C)n2 |
| Stereo: | ACHIRAL |
| logP: | 6.165 |
| logD: | 6.1641 |
| logSw: | -5.9529 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.511 |
| InChI Key: | BPSLSOGMMXVEKT-UHFFFAOYSA-N |