3-methyl-N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]butanamide
Chemical Structure Depiction of
3-methyl-N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]butanamide
3-methyl-N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]butanamide
Compound characteristics
| Compound ID: | C301-4420 |
| Compound Name: | 3-methyl-N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]butanamide |
| Molecular Weight: | 274.32 |
| Molecular Formula: | C15 H18 N2 O3 |
| Smiles: | CC(C)CC(NC1=C(c2ccccc2OC1=O)NC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7439 |
| logD: | 1.6694 |
| logSw: | -2.5162 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.364 |
| InChI Key: | DCTVTRRGNFBCGB-UHFFFAOYSA-N |