ethyl 3-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-3-(3-nitrophenyl)propanoate
Chemical Structure Depiction of
ethyl 3-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-3-(3-nitrophenyl)propanoate
ethyl 3-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-3-(3-nitrophenyl)propanoate
Compound characteristics
Compound ID: | 8012-8793 |
Compound Name: | ethyl 3-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]-3-(3-nitrophenyl)propanoate |
Molecular Weight: | 481.5 |
Molecular Formula: | C25 H27 N3 O7 |
Smiles: | CCOC(CC(c1cccc(c1)[N+]([O-])=O)NC(CCCCCN1C(c2ccccc2C1=O)=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.1719 |
logD: | 3.1719 |
logSw: | -3.5284 |
Hydrogen bond acceptors count: | 13 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 107.112 |
InChI Key: | DFNOZVJJZMWLGS-NRFANRHFSA-N |