4-bromo-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzamide
Chemical Structure Depiction of
4-bromo-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzamide
4-bromo-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzamide
Compound characteristics
| Compound ID: | G411-0143 |
| Compound Name: | 4-bromo-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzamide |
| Molecular Weight: | 413.27 |
| Molecular Formula: | C20 H17 Br N2 O3 |
| Smiles: | C1CCN(C1)C1=C(C(=O)Oc2ccccc12)NC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1185 |
| logD: | 2.3111 |
| logSw: | -4.3746 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.187 |
| InChI Key: | QAJAATOTTBUPEU-UHFFFAOYSA-N |