6-nitro-2-{[3-(trifluoromethyl)phenyl]imino}-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-nitro-2-{[3-(trifluoromethyl)phenyl]imino}-2H-1-benzopyran-3-carboxamide
6-nitro-2-{[3-(trifluoromethyl)phenyl]imino}-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 2041-2372 |
| Compound Name: | 6-nitro-2-{[3-(trifluoromethyl)phenyl]imino}-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 377.28 |
| Molecular Formula: | C17 H10 F3 N3 O4 |
| Smiles: | C1=C(/C(=N/c2cccc(c2)C(F)(F)F)Oc2ccc(cc12)[N+]([O-])=O)C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1321 |
| logD: | 3.1321 |
| logSw: | -3.6136 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.385 |
| InChI Key: | YZOPUVLWBWAGJA-UHFFFAOYSA-N |