1-[2'-(2H-1,3-benzodioxol-5-yl)-7'-ethoxy-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[2'-(2H-1,3-benzodioxol-5-yl)-7'-ethoxy-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-1-yl]ethan-1-one
1-[2'-(2H-1,3-benzodioxol-5-yl)-7'-ethoxy-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | D733-0682 |
| Compound Name: | 1-[2'-(2H-1,3-benzodioxol-5-yl)-7'-ethoxy-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-1-yl]ethan-1-one |
| Molecular Weight: | 449.51 |
| Molecular Formula: | C25 H27 N3 O5 |
| Smiles: | CCOc1cccc2C3CC(c4ccc5c(c4)OCO5)=NN3C3(CCN(CC3)C(C)=O)Oc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9751 |
| logD: | 3.9687 |
| logSw: | -4.1201 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.057 |
| InChI Key: | VUNIUXFMGVVPIP-HXUWFJFHSA-N |