N-acetyl-7-(diethylamino)-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-acetyl-7-(diethylamino)-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-1-benzopyran-3-carboxamide
N-acetyl-7-(diethylamino)-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K025-0190A |
| Compound Name: | N-acetyl-7-(diethylamino)-2-{[4-(trifluoromethoxy)phenyl]imino}-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 461.44 |
| Molecular Formula: | C23 H22 F3 N3 O4 |
| Smiles: | CCN(CC)c1ccc2C=C(/C(=N/c3ccc(cc3)OC(F)(F)F)Oc2c1)C(NC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1879 |
| logD: | 4.1509 |
| logSw: | -4.3368 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.059 |
| InChI Key: | NXTNQZNUDWZFMX-UHFFFAOYSA-N |