N-(1,3-thiazol-2-yl)-2-{[3-(trifluoromethyl)phenyl]imino}-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(1,3-thiazol-2-yl)-2-{[3-(trifluoromethyl)phenyl]imino}-2H-1-benzopyran-3-carboxamide
N-(1,3-thiazol-2-yl)-2-{[3-(trifluoromethyl)phenyl]imino}-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K218-1369 |
| Compound Name: | N-(1,3-thiazol-2-yl)-2-{[3-(trifluoromethyl)phenyl]imino}-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 415.39 |
| Molecular Formula: | C20 H12 F3 N3 O2 S |
| Smiles: | C1=C(/C(=N/c2cccc(c2)C(F)(F)F)Oc2ccccc12)C(Nc1nccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.73 |
| logD: | 4.7057 |
| logSw: | -4.8951 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.515 |
| InChI Key: | MNNFSCMHFGILLN-UHFFFAOYSA-N |