N-(4-chlorophenyl)-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
N-(4-chlorophenyl)-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D103-0010 |
| Compound Name: | N-(4-chlorophenyl)-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 313.74 |
| Molecular Formula: | C17 H12 Cl N O3 |
| Smiles: | [H]N(C(C1=CC(c2cc(C)ccc2O1)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.1796 |
| logD: | 4.1706 |
| logSw: | -4.6051 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.148 |
| InChI Key: | BTLLCEMKQITZBL-UHFFFAOYSA-N |