N-[4-(butan-2-yl)phenyl]-4-chloro-2-nitrobenzamide
Chemical Structure Depiction of
N-[4-(butan-2-yl)phenyl]-4-chloro-2-nitrobenzamide
N-[4-(butan-2-yl)phenyl]-4-chloro-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y031-9460 |
| Compound Name: | N-[4-(butan-2-yl)phenyl]-4-chloro-2-nitrobenzamide |
| Molecular Weight: | 332.78 |
| Molecular Formula: | C17 H17 Cl N2 O3 |
| Smiles: | CCC(C)c1ccc(cc1)NC(c1ccc(cc1[N+]([O-])=O)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3309 |
| logD: | 5.1543 |
| logSw: | -5.9489 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.41 |
| InChI Key: | MXTFRHQTIKSWHJ-NSHDSACASA-N |