2-chloro-N-[3-(3,4-dimethoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Chemical Structure Depiction of
2-chloro-N-[3-(3,4-dimethoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
2-chloro-N-[3-(3,4-dimethoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | 2628-3153 |
| Compound Name: | 2-chloro-N-[3-(3,4-dimethoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide |
| Molecular Weight: | 511.92 |
| Molecular Formula: | C25 H22 Cl N3 O7 |
| Smiles: | COc1ccc(C(NC(=C\c2cccc(c2)[N+]([O-])=O)\C(Nc2ccc(c(c2)OC)OC)=O)=O)c(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.2393 |
| logD: | 3.7768 |
| logSw: | -4.7757 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.44 |
| InChI Key: | SDYLXDIBEKTCRC-UHFFFAOYSA-N |