2-chloro-N-[3-(2-chloroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Chemical Structure Depiction of
2-chloro-N-[3-(2-chloroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
2-chloro-N-[3-(2-chloroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | 2628-3210 |
| Compound Name: | 2-chloro-N-[3-(2-chloroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide |
| Molecular Weight: | 486.31 |
| Molecular Formula: | C23 H17 Cl2 N3 O5 |
| Smiles: | COc1ccc(C(NC(=C\c2ccc(cc2)[N+]([O-])=O)\C(Nc2ccccc2[Cl])=O)=O)c(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0707 |
| logD: | 3.9863 |
| logSw: | -5.5058 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.482 |
| InChI Key: | MNGYVHMRCSSHRF-UHFFFAOYSA-N |