8-methoxy-N-(3-methylpent-1-yn-3-yl)-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
8-methoxy-N-(3-methylpent-1-yn-3-yl)-2-oxo-2H-1-benzopyran-3-carboxamide
8-methoxy-N-(3-methylpent-1-yn-3-yl)-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8013-2601 |
| Compound Name: | 8-methoxy-N-(3-methylpent-1-yn-3-yl)-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 299.32 |
| Molecular Formula: | C17 H17 N O4 |
| Smiles: | CCC(C)(C#C)NC(C1=Cc2cccc(c2OC1=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.45 |
| logD: | 2.45 |
| logSw: | -2.8894 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.918 |
| InChI Key: | QKBXLBOUJLGDED-QGZVFWFLSA-N |