3-(2-chloro-5-nitrophenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
Chemical Structure Depiction of
3-(2-chloro-5-nitrophenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
3-(2-chloro-5-nitrophenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
Compound characteristics
| Compound ID: | 5609-0507 |
| Compound Name: | 3-(2-chloro-5-nitrophenyl)-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide |
| Molecular Weight: | 394.82 |
| Molecular Formula: | C20 H15 Cl N4 O3 |
| Smiles: | C(CNC(C(=C\c1cc(ccc1[Cl])[N+]([O-])=O)\C#N)=O)c1c[nH]c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.9179 |
| logD: | 3.9178 |
| logSw: | -4.5237 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.802 |
| InChI Key: | HBLHCDBXZQZQOU-UHFFFAOYSA-N |