N-[3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
Chemical Structure Depiction of
N-[3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
N-[3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
Compound characteristics
| Compound ID: | 8012-9128 |
| Compound Name: | N-[3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide |
| Molecular Weight: | 458.47 |
| Molecular Formula: | C25 H22 N4 O5 |
| Smiles: | Cc1c(CCNC(/C(=C/c2cccc(c2)[N+]([O-])=O)NC(c2ccco2)=O)=O)c2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.4807 |
| logD: | 2.6977 |
| logSw: | -4.0722 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.304 |
| InChI Key: | CWCNLUCASGUBDD-UHFFFAOYSA-N |