N-[1-(4-chlorophenyl)-3-(methylamino)-3-oxoprop-1-en-2-yl]-4-nitrobenzamide
Chemical Structure Depiction of
N-[1-(4-chlorophenyl)-3-(methylamino)-3-oxoprop-1-en-2-yl]-4-nitrobenzamide
N-[1-(4-chlorophenyl)-3-(methylamino)-3-oxoprop-1-en-2-yl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | 1502-1344 |
| Compound Name: | N-[1-(4-chlorophenyl)-3-(methylamino)-3-oxoprop-1-en-2-yl]-4-nitrobenzamide |
| Molecular Weight: | 359.77 |
| Molecular Formula: | C17 H14 Cl N3 O4 |
| Smiles: | CNC(/C(=C\c1ccc(cc1)[Cl])NC(c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8124 |
| logD: | 1.5901 |
| logSw: | -3.8903 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.38 |
| InChI Key: | BRAFDKUAUPBIPX-UHFFFAOYSA-N |