2-[(3-chloro-4-fluorophenyl)imino]-6-methoxy-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
2-[(3-chloro-4-fluorophenyl)imino]-6-methoxy-2H-1-benzopyran-3-carboxamide
2-[(3-chloro-4-fluorophenyl)imino]-6-methoxy-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K025-0041 |
| Compound Name: | 2-[(3-chloro-4-fluorophenyl)imino]-6-methoxy-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 346.74 |
| Molecular Formula: | C17 H12 Cl F N2 O3 |
| Smiles: | COc1ccc2c(C=C(/C(=N/c3ccc(c(c3)[Cl])F)O2)C(N)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.9098 |
| logD: | 2.9098 |
| logSw: | -3.5759 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.548 |
| InChI Key: | HIWSQALZKHZYQN-UHFFFAOYSA-N |