4-tert-butyl-N-[3-(2-chloroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
4-tert-butyl-N-[3-(2-chloroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
4-tert-butyl-N-[3-(2-chloroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 2733-3819 |
| Compound Name: | 4-tert-butyl-N-[3-(2-chloroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 477.95 |
| Molecular Formula: | C26 H24 Cl N3 O4 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(NC(=C/c1ccc(cc1)[N+]([O-])=O)\C(Nc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2444 |
| logD: | 5.6159 |
| logSw: | -6.16 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.938 |
| InChI Key: | FUDLKUPHWNATSU-UHFFFAOYSA-N |