1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-[(6-ethoxy-3,4-dihydrospiro[[1]benzopyran-2,1'-cyclohexan]-4-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-[(6-ethoxy-3,4-dihydrospiro[[1]benzopyran-2,1'-cyclohexan]-4-yl)sulfanyl]ethan-1-one
1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-[(6-ethoxy-3,4-dihydrospiro[[1]benzopyran-2,1'-cyclohexan]-4-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | C538-0906 |
| Compound Name: | 1-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-[(6-ethoxy-3,4-dihydrospiro[[1]benzopyran-2,1'-cyclohexan]-4-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 461.62 |
| Molecular Formula: | C25 H35 N O5 S |
| Smiles: | CCOc1ccc2c(c1)C(CC1(CCCCC1)O2)SCC(N1CCC2(CC1)OCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9192 |
| logD: | 3.9192 |
| logSw: | -3.8957 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 43.655 |
| InChI Key: | FTCCYXCEVNVBLM-QFIPXVFZSA-N |