2-chloro-N-[3-(1H-imidazol-1-yl)propyl]-5-nitrobenzamide
Chemical Structure Depiction of
2-chloro-N-[3-(1H-imidazol-1-yl)propyl]-5-nitrobenzamide
2-chloro-N-[3-(1H-imidazol-1-yl)propyl]-5-nitrobenzamide
Compound characteristics
| Compound ID: | Y508-1573 |
| Compound Name: | 2-chloro-N-[3-(1H-imidazol-1-yl)propyl]-5-nitrobenzamide |
| Molecular Weight: | 308.72 |
| Molecular Formula: | C13 H13 Cl N4 O3 |
| Smiles: | C(CNC(c1cc(ccc1[Cl])[N+]([O-])=O)=O)Cn1ccnc1 |
| Stereo: | ACHIRAL |
| logP: | 1.7043 |
| logD: | 1.4624 |
| logSw: | -3.0789 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.675 |
| InChI Key: | HFYVZQMDCZYNIQ-UHFFFAOYSA-N |