7-hydroxy-4-methyl-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-hydroxy-4-methyl-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2H-1-benzopyran-2-one
7-hydroxy-4-methyl-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D144-1073 |
| Compound Name: | 7-hydroxy-4-methyl-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 301.34 |
| Molecular Formula: | C17 H19 N O4 |
| Smiles: | CC1=C(CCC(N2CCCC2)=O)C(=O)Oc2cc(ccc12)O |
| Stereo: | ACHIRAL |
| logP: | 1.9979 |
| logD: | 1.9687 |
| logSw: | -2.6055 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.264 |
| InChI Key: | RVBBWGIQWSMAIG-UHFFFAOYSA-N |