N-[4-(4-tert-butylbenzamido)phenyl]-4-ethoxy-3-nitrobenzamide
Chemical Structure Depiction of
N-[4-(4-tert-butylbenzamido)phenyl]-4-ethoxy-3-nitrobenzamide
N-[4-(4-tert-butylbenzamido)phenyl]-4-ethoxy-3-nitrobenzamide
Compound characteristics
| Compound ID: | 2154-1027 |
| Compound Name: | N-[4-(4-tert-butylbenzamido)phenyl]-4-ethoxy-3-nitrobenzamide |
| Molecular Weight: | 461.52 |
| Molecular Formula: | C26 H27 N3 O5 |
| Smiles: | CCOc1ccc(cc1[N+]([O-])=O)C(Nc1ccc(cc1)NC(c1ccc(cc1)C(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6083 |
| logD: | 5.6077 |
| logSw: | -5.3833 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.712 |
| InChI Key: | IKHWWJWVZYOMBB-UHFFFAOYSA-N |