N-benzyl-7-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-benzyl-7-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
N-benzyl-7-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D103-0115 |
| Compound Name: | N-benzyl-7-methyl-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 293.32 |
| Molecular Formula: | C18 H15 N O3 |
| Smiles: | [H]N(Cc1ccccc1)C(C1=CC(c2ccc(C)cc2O1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3933 |
| logD: | 3.3932 |
| logSw: | -3.8264 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.47 |
| InChI Key: | ZCTQIVLSLXHCHL-UHFFFAOYSA-N |