N-(3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-3-oxo-1-phenylprop-1-en-2-yl)-3-nitrobenzamide
Chemical Structure Depiction of
N-(3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-3-oxo-1-phenylprop-1-en-2-yl)-3-nitrobenzamide
N-(3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-3-oxo-1-phenylprop-1-en-2-yl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8012-8941 |
| Compound Name: | N-(3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-3-oxo-1-phenylprop-1-en-2-yl)-3-nitrobenzamide |
| Molecular Weight: | 468.51 |
| Molecular Formula: | C27 H24 N4 O4 |
| Smiles: | Cc1c(CCNC(/C(=C/c2ccccc2)NC(c2cccc(c2)[N+]([O-])=O)=O)=O)c2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 4.35 |
| logD: | 2.226 |
| logSw: | -4.5429 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.725 |
| InChI Key: | PRQTVSDALCMFSF-UHFFFAOYSA-N |