N-(3-chloro-4-methoxyphenyl)-1-oxo-4-phenyl-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-1-oxo-4-phenyl-1H-2-benzopyran-3-carboxamide
N-(3-chloro-4-methoxyphenyl)-1-oxo-4-phenyl-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K953-0512 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-1-oxo-4-phenyl-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 405.84 |
| Molecular Formula: | C23 H16 Cl N O4 |
| Smiles: | COc1ccc(cc1[Cl])NC(C1=C(c2ccccc2)c2ccccc2C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6824 |
| logD: | 4.6802 |
| logSw: | -4.9812 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.689 |
| InChI Key: | HTPPMXWZJIMPEV-UHFFFAOYSA-N |