6-chloro-N-(2-cyanophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-chloro-N-(2-cyanophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
6-chloro-N-(2-cyanophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | Y200-6501 |
| Compound Name: | 6-chloro-N-(2-cyanophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 324.72 |
| Molecular Formula: | C17 H9 Cl N2 O3 |
| Smiles: | C1=C(C(Nc2ccccc2C#N)=O)C(=O)Oc2ccc(cc12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.1049 |
| logD: | 2.6723 |
| logSw: | -3.8819 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.61 |
| InChI Key: | LXVCAMUKQRKMTQ-UHFFFAOYSA-N |