9-bromo-3,4-dihydro-1H-[1]benzofuro[3,2-b]azepine-2,5-dione
Chemical Structure Depiction of
9-bromo-3,4-dihydro-1H-[1]benzofuro[3,2-b]azepine-2,5-dione
9-bromo-3,4-dihydro-1H-[1]benzofuro[3,2-b]azepine-2,5-dione
Compound characteristics
| Compound ID: | 8015-3458 |
| Compound Name: | 9-bromo-3,4-dihydro-1H-[1]benzofuro[3,2-b]azepine-2,5-dione |
| Molecular Weight: | 294.1 |
| Molecular Formula: | C12 H8 Br N O3 |
| Smiles: | C1CC(Nc2c3cc(ccc3oc2C1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.0497 |
| logD: | 2.0145 |
| logSw: | -2.9054 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.534 |
| InChI Key: | NCGFATOCQZMUJN-UHFFFAOYSA-N |