9'-bromo-1-methyl-2'-(5-methylfuran-2-yl)-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Chemical Structure Depiction of
9'-bromo-1-methyl-2'-(5-methylfuran-2-yl)-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
9'-bromo-1-methyl-2'-(5-methylfuran-2-yl)-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Compound characteristics
| Compound ID: | D731-0698 |
| Compound Name: | 9'-bromo-1-methyl-2'-(5-methylfuran-2-yl)-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine] |
| Molecular Weight: | 416.32 |
| Molecular Formula: | C20 H22 Br N3 O2 |
| Smiles: | Cc1ccc(C2CC3c4cc(ccc4OC4(CCN(C)CC4)N3N=2)[Br])o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2052 |
| logD: | 2.6681 |
| logSw: | -4.3627 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.421 |
| InChI Key: | WTYFULIJGJITQY-KRWDZBQOSA-N |