N-cyclohexyl-2-[(2,2-dimethoxyethyl)(methyl)amino]-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
Chemical Structure Depiction of
N-cyclohexyl-2-[(2,2-dimethoxyethyl)(methyl)amino]-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
N-cyclohexyl-2-[(2,2-dimethoxyethyl)(methyl)amino]-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
Compound characteristics
Compound ID: | C094-2389 |
Compound Name: | N-cyclohexyl-2-[(2,2-dimethoxyethyl)(methyl)amino]-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide |
Molecular Weight: | 423.47 |
Molecular Formula: | C20 H29 N3 O7 |
Smiles: | CN(CC(OC)OC)C(C(NC1CCCCC1)=O)c1cc2c(cc1[N+]([O-])=O)OCO2 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.2155 |
logD: | 2.171 |
logSw: | -2.715 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 92.866 |
InChI Key: | OTBQGMMYWYULHX-LJQANCHMSA-N |