1'-[(2-chlorophenyl)methyl]-5-(hydroxymethyl)-5-nitrospiro[[1,3]dioxane-2,3'-indol]-2'(1'H)-one
Chemical Structure Depiction of
1'-[(2-chlorophenyl)methyl]-5-(hydroxymethyl)-5-nitrospiro[[1,3]dioxane-2,3'-indol]-2'(1'H)-one
1'-[(2-chlorophenyl)methyl]-5-(hydroxymethyl)-5-nitrospiro[[1,3]dioxane-2,3'-indol]-2'(1'H)-one
Compound characteristics
| Compound ID: | 8017-2308 |
| Compound Name: | 1'-[(2-chlorophenyl)methyl]-5-(hydroxymethyl)-5-nitrospiro[[1,3]dioxane-2,3'-indol]-2'(1'H)-one |
| Molecular Weight: | 404.81 |
| Molecular Formula: | C19 H17 Cl N2 O6 |
| Smiles: | C(c1ccccc1[Cl])N1C(C2(c3ccccc13)OCC(CO)(CO2)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8791 |
| logD: | 2.8791 |
| logSw: | -3.4889 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.323 |
| InChI Key: | PBEOVCQRGJUAMZ-UHFFFAOYSA-N |