9-bromo-5,5-diethyl-5H-isoindolo[2,1-a][3,1]benzoxazin-11(6aH)-one
Chemical Structure Depiction of
9-bromo-5,5-diethyl-5H-isoindolo[2,1-a][3,1]benzoxazin-11(6aH)-one
9-bromo-5,5-diethyl-5H-isoindolo[2,1-a][3,1]benzoxazin-11(6aH)-one
Compound characteristics
Compound ID: | 8020-1519 |
Compound Name: | 9-bromo-5,5-diethyl-5H-isoindolo[2,1-a][3,1]benzoxazin-11(6aH)-one |
Molecular Weight: | 372.26 |
Molecular Formula: | C19 H18 Br N O2 |
Smiles: | CCC1(CC)c2ccccc2N2C(c3ccc(cc3C2=O)[Br])O1 |
Stereo: | RACEMIC MIXTURE |
logP: | 5.0927 |
logD: | 5.0927 |
logSw: | -4.9145 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 23.1037 |
InChI Key: | LUPKPSAMZMPYMR-GOSISDBHSA-N |