N-(4-chlorophenyl)-4-(4-methylanilino)-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-4-(4-methylanilino)-3,5-dinitrobenzamide
N-(4-chlorophenyl)-4-(4-methylanilino)-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | 8006-6929 |
| Compound Name: | N-(4-chlorophenyl)-4-(4-methylanilino)-3,5-dinitrobenzamide |
| Molecular Weight: | 426.81 |
| Molecular Formula: | C20 H15 Cl N4 O5 |
| Smiles: | Cc1ccc(cc1)Nc1c(cc(cc1[N+]([O-])=O)C(Nc1ccc(cc1)[Cl])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3308 |
| logD: | 4.7396 |
| logSw: | -5.9935 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.008 |
| InChI Key: | PURKLBYSEIDQIV-UHFFFAOYSA-N |