N-(5-chloro-2-methoxyphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
N-(5-chloro-2-methoxyphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K219-0219 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 329.74 |
| Molecular Formula: | C17 H12 Cl N O4 |
| Smiles: | COc1ccc(cc1NC(C1=Cc2ccccc2OC1=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3288 |
| logD: | 2.4454 |
| logSw: | -3.7176 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.184 |
| InChI Key: | JJILXLFYTCPGLJ-UHFFFAOYSA-N |