1-[2'-(3,4-dimethylphenyl)-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'-(3,4-dimethylphenyl)-7'-ethoxy-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-1-yl]ethan-1-one
1-[2'-(3,4-dimethylphenyl)-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: | D733-0724 |
| Compound Name: | 1-[2'-(3,4-dimethylphenyl)-7'-ethoxy-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-1-yl]ethan-1-one |
| Molecular Weight: | 433.55 |
| Molecular Formula: | C26 H31 N3 O3 |
| Smiles: | CCOc1cccc2C3CC(c4ccc(C)c(C)c4)=NN3C3(CCN(CC3)C(C)=O)Oc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0386 |
| logD: | 5.0358 |
| logSw: | -4.6509 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.942 |
| InChI Key: | LKFXZTZXMQGGFE-HSZRJFAPSA-N |