3-bromo-N-[3-(4-chloro-2-nitroanilino)propyl]benzamide
Chemical Structure Depiction of
3-bromo-N-[3-(4-chloro-2-nitroanilino)propyl]benzamide
3-bromo-N-[3-(4-chloro-2-nitroanilino)propyl]benzamide
Compound characteristics
| Compound ID: | 2023-0594 |
| Compound Name: | 3-bromo-N-[3-(4-chloro-2-nitroanilino)propyl]benzamide |
| Molecular Weight: | 412.67 |
| Molecular Formula: | C16 H15 Br Cl N3 O3 |
| Smiles: | C(CNC(c1cccc(c1)[Br])=O)CNc1ccc(cc1[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.1787 |
| logD: | 4.1787 |
| logSw: | -4.5587 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.224 |
| InChI Key: | IZQIGLMXXYEGLU-UHFFFAOYSA-N |