3-bromo-4-methoxy-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzamide
Chemical Structure Depiction of
3-bromo-4-methoxy-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzamide
3-bromo-4-methoxy-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzamide
Compound characteristics
| Compound ID: | G411-0130 |
| Compound Name: | 3-bromo-4-methoxy-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzamide |
| Molecular Weight: | 443.3 |
| Molecular Formula: | C21 H19 Br N2 O4 |
| Smiles: | COc1ccc(cc1[Br])C(NC1=C(c2ccccc2OC1=O)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9226 |
| logD: | 2.4521 |
| logSw: | -4.0392 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.817 |
| InChI Key: | OXPYWMDUCZNSRE-UHFFFAOYSA-N |