N-(4-butylphenyl)-4-chloro-2-nitrobenzamide
Chemical Structure Depiction of
N-(4-butylphenyl)-4-chloro-2-nitrobenzamide
N-(4-butylphenyl)-4-chloro-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y031-9459 |
| Compound Name: | N-(4-butylphenyl)-4-chloro-2-nitrobenzamide |
| Molecular Weight: | 332.78 |
| Molecular Formula: | C17 H17 Cl N2 O3 |
| Smiles: | CCCCc1ccc(cc1)NC(c1ccc(cc1[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.372 |
| logD: | 5.1955 |
| logSw: | -5.7739 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.41 |
| InChI Key: | UCOJHSFEMNWERJ-UHFFFAOYSA-N |