1'-[(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methyl]-5-(hydroxymethyl)-5-nitrospiro[[1,3]dioxane-2,3'-indol]-2'(1'H)-one
Chemical Structure Depiction of
1'-[(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methyl]-5-(hydroxymethyl)-5-nitrospiro[[1,3]dioxane-2,3'-indol]-2'(1'H)-one
1'-[(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methyl]-5-(hydroxymethyl)-5-nitrospiro[[1,3]dioxane-2,3'-indol]-2'(1'H)-one
Compound characteristics
| Compound ID: | 8017-9213 |
| Compound Name: | 1'-[(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methyl]-5-(hydroxymethyl)-5-nitrospiro[[1,3]dioxane-2,3'-indol]-2'(1'H)-one |
| Molecular Weight: | 435.43 |
| Molecular Formula: | C20 H25 N3 O8 |
| Smiles: | C1CN(CCC12OCCO2)CN1C(C2(c3ccccc13)OCC(CO)(CO2)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8919 |
| logD: | -1.3454 |
| logSw: | -2.0425 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.186 |
| InChI Key: | RUUIJRACJMNZQY-UHFFFAOYSA-N |