N-[3-(5-chloro-2-methoxyanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-methylbenzamide
Chemical Structure Depiction of
N-[3-(5-chloro-2-methoxyanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-methylbenzamide
N-[3-(5-chloro-2-methoxyanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-methylbenzamide
Compound characteristics
| Compound ID: | 2681-3477 |
| Compound Name: | N-[3-(5-chloro-2-methoxyanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-methylbenzamide |
| Molecular Weight: | 465.89 |
| Molecular Formula: | C24 H20 Cl N3 O5 |
| Smiles: | Cc1cccc(c1)C(NC(=C/c1ccc(cc1)[N+]([O-])=O)\C(Nc1cc(ccc1OC)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0231 |
| logD: | 4.4584 |
| logSw: | -5.3992 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.568 |
| InChI Key: | WHOUUSSWLDGHMF-UHFFFAOYSA-N |