N-[3-anilino-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-chloro-4-methoxybenzamide
Chemical Structure Depiction of
N-[3-anilino-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-chloro-4-methoxybenzamide
N-[3-anilino-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-chloro-4-methoxybenzamide
Compound characteristics
| Compound ID: | 2628-3213 |
| Compound Name: | N-[3-anilino-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-chloro-4-methoxybenzamide |
| Molecular Weight: | 451.87 |
| Molecular Formula: | C23 H18 Cl N3 O5 |
| Smiles: | COc1ccc(C(NC(=C\c2ccc(cc2)[N+]([O-])=O)\C(Nc2ccccc2)=O)=O)c(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.63 |
| logD: | 4.2718 |
| logSw: | -5.0747 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.179 |
| InChI Key: | FRWCGOKEMLNALT-UHFFFAOYSA-N |