N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2,4-dinitrobenzamide
Chemical Structure Depiction of
N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2,4-dinitrobenzamide
N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2,4-dinitrobenzamide
Compound characteristics
| Compound ID: | 0389-0996 |
| Compound Name: | N-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2,4-dinitrobenzamide |
| Molecular Weight: | 398.4 |
| Molecular Formula: | C18 H14 N4 O5 S |
| Smiles: | Cc1ccc(C)c(c1)c1csc(NC(c2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.9763 |
| logD: | 4.9292 |
| logSw: | -4.6827 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.567 |
| InChI Key: | IJBWIOOCLPCRRA-UHFFFAOYSA-N |