9'-bromo-2'-(5-methylfuran-2-yl)-4-phenyl-1',10'b-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Chemical Structure Depiction of
9'-bromo-2'-(5-methylfuran-2-yl)-4-phenyl-1',10'b-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine]
9'-bromo-2'-(5-methylfuran-2-yl)-4-phenyl-1',10'b-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Compound characteristics
| Compound ID: | IB01-3999 |
| Compound Name: | 9'-bromo-2'-(5-methylfuran-2-yl)-4-phenyl-1',10'b-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine] |
| Molecular Weight: | 477.4 |
| Molecular Formula: | C26 H25 Br N2 O2 |
| Smiles: | Cc1ccc(C2CC3c4cc(ccc4OC4(CCC(CC4)c4ccccc4)N3N=2)[Br])o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.51 |
| logD: | 7.51 |
| logSw: | -7.94 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 37.88 |
| InChI Key: | QLBAJGRGEYFNLW-GFXGUTMFSA-N |