N-[4-nitro-2-(trifluoromethyl)phenyl]-9H-xanthene-9-carboxamide
Chemical Structure Depiction of
N-[4-nitro-2-(trifluoromethyl)phenyl]-9H-xanthene-9-carboxamide
N-[4-nitro-2-(trifluoromethyl)phenyl]-9H-xanthene-9-carboxamide
Compound characteristics
| Compound ID: | Y205-8080 |
| Compound Name: | N-[4-nitro-2-(trifluoromethyl)phenyl]-9H-xanthene-9-carboxamide |
| Molecular Weight: | 414.34 |
| Molecular Formula: | C21 H13 F3 N2 O4 |
| Smiles: | c1ccc2c(c1)C(C(Nc1ccc(cc1C(F)(F)F)[N+]([O-])=O)=O)c1ccccc1O2 |
| Stereo: | ACHIRAL |
| logP: | 4.9763 |
| logD: | -2.3243 |
| logSw: | -4.9042 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.827 |
| InChI Key: | RNCUFOXUYHBYFV-UHFFFAOYSA-N |