9-bromo-5,5-diphenyl-5H-isoindolo[2,1-a][3,1]benzoxazin-11(6aH)-one
Chemical Structure Depiction of
9-bromo-5,5-diphenyl-5H-isoindolo[2,1-a][3,1]benzoxazin-11(6aH)-one
9-bromo-5,5-diphenyl-5H-isoindolo[2,1-a][3,1]benzoxazin-11(6aH)-one
Compound characteristics
| Compound ID: | 8020-1518 |
| Compound Name: | 9-bromo-5,5-diphenyl-5H-isoindolo[2,1-a][3,1]benzoxazin-11(6aH)-one |
| Molecular Weight: | 468.35 |
| Molecular Formula: | C27 H18 Br N O2 |
| Smiles: | c1ccc(cc1)C1(c2ccccc2)c2ccccc2N2C(c3ccc(cc3C2=O)[Br])O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7801 |
| logD: | 6.78 |
| logSw: | -6.173 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 22.0758 |
| InChI Key: | SFJPQEKQUIGHEN-AREMUKBSSA-N |