3',5'-di-tert-butyl-6-chloro-2-ethenyl-2H,4H-spiro[[1,4]benzoxazine-3,1'-cyclohexa[2,5]dien]-4'-one
Chemical Structure Depiction of
3',5'-di-tert-butyl-6-chloro-2-ethenyl-2H,4H-spiro[[1,4]benzoxazine-3,1'-cyclohexa[2,5]dien]-4'-one
3',5'-di-tert-butyl-6-chloro-2-ethenyl-2H,4H-spiro[[1,4]benzoxazine-3,1'-cyclohexa[2,5]dien]-4'-one
Compound characteristics
| Compound ID: | 8009-2000 |
| Compound Name: | 3',5'-di-tert-butyl-6-chloro-2-ethenyl-2H,4H-spiro[[1,4]benzoxazine-3,1'-cyclohexa[2,5]dien]-4'-one |
| Molecular Weight: | 385.93 |
| Molecular Formula: | C23 H28 Cl N O2 |
| Smiles: | CC(C)(C)C1=CC2(C=C(C1=O)C(C)(C)C)C(C=C)Oc1ccc(cc1N2)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.2261 |
| logD: | 7.2261 |
| logSw: | -6.3376 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.385 |
| InChI Key: | RUYXBXQMOZOPDU-IBGZPJMESA-N |