3-methyl-1-oxo-N-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
3-methyl-1-oxo-N-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide
3-methyl-1-oxo-N-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | D001-0022 |
| Compound Name: | 3-methyl-1-oxo-N-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 349.31 |
| Molecular Formula: | C18 H14 F3 N O3 |
| Smiles: | CC1(Cc2ccccc2C(=O)O1)C(Nc1ccccc1C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0557 |
| logD: | 4.0557 |
| logSw: | -4.353 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.753 |
| InChI Key: | GBKYOXPZDRJLHJ-KRWDZBQOSA-N |