N-[(4-tert-butylphenyl)methyl]-2-nitro-N-(pyridin-2-yl)benzamide
Chemical Structure Depiction of
N-[(4-tert-butylphenyl)methyl]-2-nitro-N-(pyridin-2-yl)benzamide
N-[(4-tert-butylphenyl)methyl]-2-nitro-N-(pyridin-2-yl)benzamide
Compound characteristics
| Compound ID: | D341-0976 |
| Compound Name: | N-[(4-tert-butylphenyl)methyl]-2-nitro-N-(pyridin-2-yl)benzamide |
| Molecular Weight: | 389.45 |
| Molecular Formula: | C23 H23 N3 O3 |
| Smiles: | CC(C)(C)c1ccc(CN(C(c2ccccc2[N+]([O-])=O)=O)c2ccccn2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5167 |
| logD: | 5.5166 |
| logSw: | -5.3326 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.181 |
| InChI Key: | RPDWKLWKEYLRML-UHFFFAOYSA-N |