4-(9'-chloro-1-ethyl-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2'-yl)phenol
Chemical Structure Depiction of
4-(9'-chloro-1-ethyl-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2'-yl)phenol
4-(9'-chloro-1-ethyl-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2'-yl)phenol
Compound characteristics
| Compound ID: | D733-0622 |
| Compound Name: | 4-(9'-chloro-1-ethyl-1',10'b-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2'-yl)phenol |
| Molecular Weight: | 397.9 |
| Molecular Formula: | C22 H24 Cl N3 O2 |
| Smiles: | CCN1CCC2(CC1)N1C(CC(c3ccc(cc3)O)=N1)c1cc(ccc1O2)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4433 |
| logD: | 2.7561 |
| logSw: | -4.3933 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.006 |
| InChI Key: | CBNXJPFWPLPVTI-FQEVSTJZSA-N |