4-chloro-2-(7'-methoxy-1-methyl-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2'-yl)phenol
Chemical Structure Depiction of
4-chloro-2-(7'-methoxy-1-methyl-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2'-yl)phenol
4-chloro-2-(7'-methoxy-1-methyl-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2'-yl)phenol
Compound characteristics
| Compound ID: | D733-0701 |
| Compound Name: | 4-chloro-2-(7'-methoxy-1-methyl-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2'-yl)phenol |
| Molecular Weight: | 413.9 |
| Molecular Formula: | C22 H24 Cl N3 O3 |
| Smiles: | CN1CCC2(CC1)N1C(CC(c3cc(ccc3O)[Cl])=N1)c1cccc(c1O2)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5344 |
| logD: | 2.9973 |
| logSw: | -4.4911 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.191 |
| InChI Key: | INNHUEXUOIFJKN-GOSISDBHSA-N |