4-butyl-N-[3-(2-methoxy-4-nitroanilino)-1-(4-methylphenyl)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
4-butyl-N-[3-(2-methoxy-4-nitroanilino)-1-(4-methylphenyl)-3-oxoprop-1-en-2-yl]benzamide
4-butyl-N-[3-(2-methoxy-4-nitroanilino)-1-(4-methylphenyl)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 2447-3011 |
| Compound Name: | 4-butyl-N-[3-(2-methoxy-4-nitroanilino)-1-(4-methylphenyl)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 487.56 |
| Molecular Formula: | C28 H29 N3 O5 |
| Smiles: | CCCCc1ccc(cc1)C(NC(=C/c1ccc(C)cc1)\C(Nc1ccc(cc1OC)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6815 |
| logD: | 5.1882 |
| logSw: | -5.5483 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.568 |
| InChI Key: | YGGKGJVYUXLVRJ-UHFFFAOYSA-N |