N-[3-(4-bromoanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-chlorobenzamide
Chemical Structure Depiction of
N-[3-(4-bromoanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-chlorobenzamide
N-[3-(4-bromoanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-chlorobenzamide
Compound characteristics
| Compound ID: | 2681-3581 |
| Compound Name: | N-[3-(4-bromoanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-chlorobenzamide |
| Molecular Weight: | 500.73 |
| Molecular Formula: | C22 H15 Br Cl N3 O4 |
| Smiles: | C(=C(/C(Nc1ccc(cc1)[Br])=O)NC(c1cccc(c1)[Cl])=O)\c1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5803 |
| logD: | 4.9287 |
| logSw: | -6.1124 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.636 |
| InChI Key: | LFQRWCXNOYQCJD-UHFFFAOYSA-N |