N-(2,2-dimethoxyethyl)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitrobenzamide
Chemical Structure Depiction of
N-(2,2-dimethoxyethyl)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitrobenzamide
N-(2,2-dimethoxyethyl)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | K781-4065 |
| Compound Name: | N-(2,2-dimethoxyethyl)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitrobenzamide |
| Molecular Weight: | 395.41 |
| Molecular Formula: | C18 H25 N3 O7 |
| Smiles: | COC(CNC(c1ccc(c(c1)[N+]([O-])=O)N1CCC2(CC1)OCCO2)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 0.5794 |
| logD: | 0.5793 |
| logSw: | -2.2059 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.087 |
| InChI Key: | CPKSZEKQQIGPMS-UHFFFAOYSA-N |