6,8-dibromo-7-hydroxy-2,3,4,5-tetrahydro-1H-[1]benzofuro[2,3-c]azepin-1-one
Chemical Structure Depiction of
6,8-dibromo-7-hydroxy-2,3,4,5-tetrahydro-1H-[1]benzofuro[2,3-c]azepin-1-one
6,8-dibromo-7-hydroxy-2,3,4,5-tetrahydro-1H-[1]benzofuro[2,3-c]azepin-1-one
Compound characteristics
| Compound ID: | 8015-8296 |
| Compound Name: | 6,8-dibromo-7-hydroxy-2,3,4,5-tetrahydro-1H-[1]benzofuro[2,3-c]azepin-1-one |
| Molecular Weight: | 375.01 |
| Molecular Formula: | C12 H9 Br2 N O3 |
| Smiles: | C1Cc2c3c(c(c(cc3oc2C(NC1)=O)[Br])O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.4434 |
| logD: | 3.276 |
| logSw: | -3.8215 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.197 |
| InChI Key: | AJBFRFDRURUSAE-UHFFFAOYSA-N |