6-bromo-3',5'-di-tert-butyl-2-phenyl-2H,4H-spiro[[1,4]benzoxazine-3,1'-cyclohexa[2,5]dien]-4'-one
Chemical Structure Depiction of
6-bromo-3',5'-di-tert-butyl-2-phenyl-2H,4H-spiro[[1,4]benzoxazine-3,1'-cyclohexa[2,5]dien]-4'-one
6-bromo-3',5'-di-tert-butyl-2-phenyl-2H,4H-spiro[[1,4]benzoxazine-3,1'-cyclohexa[2,5]dien]-4'-one
Compound characteristics
| Compound ID: | 8009-3186 |
| Compound Name: | 6-bromo-3',5'-di-tert-butyl-2-phenyl-2H,4H-spiro[[1,4]benzoxazine-3,1'-cyclohexa[2,5]dien]-4'-one |
| Molecular Weight: | 480.44 |
| Molecular Formula: | C27 H30 Br N O2 |
| Smiles: | CC(C)(C)C1=CC2(C=C(C1=O)C(C)(C)C)C(c1ccccc1)Oc1ccc(cc1N2)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.4885 |
| logD: | 8.4885 |
| logSw: | -5.8021 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.871 |
| InChI Key: | GRHZKJFWKKKIPG-DEOSSOPVSA-N |