3-methyl-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]butanamide
Chemical Structure Depiction of
3-methyl-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]butanamide
3-methyl-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]butanamide
Compound characteristics
| Compound ID: | G312-0117 |
| Compound Name: | 3-methyl-N-[2-oxo-4-(propylamino)-2H-1-benzopyran-3-yl]butanamide |
| Molecular Weight: | 302.37 |
| Molecular Formula: | C17 H22 N2 O3 |
| Smiles: | CCCNC1=C(C(=O)Oc2ccccc12)NC(CC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5477 |
| logD: | 2.4749 |
| logSw: | -3.1652 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.055 |
| InChI Key: | ONXLOQJZWFDEQA-UHFFFAOYSA-N |