5-chloro-N-[3-(2,4-difluoroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
Chemical Structure Depiction of
5-chloro-N-[3-(2,4-difluoroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
5-chloro-N-[3-(2,4-difluoroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
Compound characteristics
| Compound ID: | 2681-3552 |
| Compound Name: | 5-chloro-N-[3-(2,4-difluoroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide |
| Molecular Weight: | 487.85 |
| Molecular Formula: | C23 H16 Cl F2 N3 O5 |
| Smiles: | COc1ccc(cc1C(NC(=C/c1cccc(c1)[N+]([O-])=O)\C(Nc1ccc(cc1F)F)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8613 |
| logD: | 2.0966 |
| logSw: | -5.004 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.568 |
| InChI Key: | BJIVEEFYUVEQPG-UHFFFAOYSA-N |