6-bromo-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-1-benzopyran-3-carboxamide
6-bromo-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K025-0187 |
| Compound Name: | 6-bromo-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 427.18 |
| Molecular Formula: | C17 H10 Br F3 N2 O3 |
| Smiles: | C1=C(/C(=N/c2ccc(cc2)OC(F)(F)F)Oc2ccc(cc12)[Br])C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0611 |
| logD: | 4.0611 |
| logSw: | -4.5335 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.941 |
| InChI Key: | JIYCILSHDFLXSY-UHFFFAOYSA-N |