N-[3-(4-tert-butylbenzamido)phenyl]-4-methyl-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-[3-(4-tert-butylbenzamido)phenyl]-4-methyl-3,5-dinitrobenzamide
N-[3-(4-tert-butylbenzamido)phenyl]-4-methyl-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | 1141-0041 |
| Compound Name: | N-[3-(4-tert-butylbenzamido)phenyl]-4-methyl-3,5-dinitrobenzamide |
| Molecular Weight: | 476.49 |
| Molecular Formula: | C25 H24 N4 O6 |
| Smiles: | Cc1c(cc(cc1[N+]([O-])=O)C(Nc1cccc(c1)NC(c1ccc(cc1)C(C)(C)C)=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.526 |
| logD: | 5.5084 |
| logSw: | -5.4598 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 112.582 |
| InChI Key: | CFHFRHNXAPSJGC-UHFFFAOYSA-N |