N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]-2H-1,3-benzodioxole-5-carboxamide
N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | G411-0119 |
| Compound Name: | N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 378.38 |
| Molecular Formula: | C21 H18 N2 O5 |
| Smiles: | C1CCN(C1)C1=C(C(=O)Oc2ccccc12)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.207 |
| logD: | 2.9304 |
| logSw: | -3.6891 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.302 |
| InChI Key: | IRBOGJVUNPIBFE-UHFFFAOYSA-N |