2-[(3-chloro-4-fluorophenyl)imino]-7-(diethylamino)-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
2-[(3-chloro-4-fluorophenyl)imino]-7-(diethylamino)-2H-1-benzopyran-3-carboxamide
2-[(3-chloro-4-fluorophenyl)imino]-7-(diethylamino)-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K025-0046 |
| Compound Name: | 2-[(3-chloro-4-fluorophenyl)imino]-7-(diethylamino)-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 387.84 |
| Molecular Formula: | C20 H19 Cl F N3 O2 |
| Smiles: | CCN(CC)c1ccc2C=C(\C(=N/c3ccc(c(c3)[Cl])F)Oc2c1)C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8808 |
| logD: | 3.8807 |
| logSw: | -4.4617 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.74 |
| InChI Key: | WQKFRGPAXWVPRH-UHFFFAOYSA-N |