1-(4-{[2-(1H-indol-3-yl)ethyl]amino}-3-nitrophenyl)-3-methylpyrrolidine-2,5-dione
Chemical Structure Depiction of
1-(4-{[2-(1H-indol-3-yl)ethyl]amino}-3-nitrophenyl)-3-methylpyrrolidine-2,5-dione
1-(4-{[2-(1H-indol-3-yl)ethyl]amino}-3-nitrophenyl)-3-methylpyrrolidine-2,5-dione
Compound characteristics
Compound ID: | K807-4535 |
Compound Name: | 1-(4-{[2-(1H-indol-3-yl)ethyl]amino}-3-nitrophenyl)-3-methylpyrrolidine-2,5-dione |
Molecular Weight: | 392.41 |
Molecular Formula: | C21 H20 N4 O4 |
Smiles: | CC1CC(N(C1=O)c1ccc(c(c1)[N+]([O-])=O)NCCc1c[nH]c2ccccc12)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.796 |
logD: | 2.796 |
logSw: | -3.4097 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.759 |
InChI Key: | ITXBAAIUUSVWML-CYBMUJFWSA-N |