1-(7-butyl-7-hydroxy-5-oxa-2-azaspiro[3.4]octan-2-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-1-one
Chemical Structure Depiction of
1-(7-butyl-7-hydroxy-5-oxa-2-azaspiro[3.4]octan-2-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-1-one
1-(7-butyl-7-hydroxy-5-oxa-2-azaspiro[3.4]octan-2-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-1-one
Compound characteristics
| Compound ID: | SA47-0687 |
| Compound Name: | 1-(7-butyl-7-hydroxy-5-oxa-2-azaspiro[3.4]octan-2-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)propan-1-one |
| Molecular Weight: | 335.45 |
| Molecular Formula: | C18 H29 N3 O3 |
| Smiles: | CCCCC1(CC2(CN(C2)C(CCn2c(C)cc(C)n2)=O)OC1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0986 |
| logD: | 1.0984 |
| logSw: | -1.3097 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.582 |
| InChI Key: | XERFTTLFIQEKSI-KRWDZBQOSA-N |