N-[3-(1H-imidazol-1-yl)propyl]-3-methyl-4-nitrobenzamide
Chemical Structure Depiction of
N-[3-(1H-imidazol-1-yl)propyl]-3-methyl-4-nitrobenzamide
N-[3-(1H-imidazol-1-yl)propyl]-3-methyl-4-nitrobenzamide
Compound characteristics
| Compound ID: | Y203-6713 |
| Compound Name: | N-[3-(1H-imidazol-1-yl)propyl]-3-methyl-4-nitrobenzamide |
| Molecular Weight: | 288.3 |
| Molecular Formula: | C14 H16 N4 O3 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)C(NCCCn1ccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3526 |
| logD: | 1.1107 |
| logSw: | -1.9966 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.374 |
| InChI Key: | ZLESHAUNJDFPKM-UHFFFAOYSA-N |