N-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]-2,4-dinitrobenzamide
Chemical Structure Depiction of
N-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]-2,4-dinitrobenzamide
N-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]-2,4-dinitrobenzamide
Compound characteristics
| Compound ID: | 0831-0021 |
| Compound Name: | N-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]-2,4-dinitrobenzamide |
| Molecular Weight: | 420.4 |
| Molecular Formula: | C20 H12 N4 O5 S |
| Smiles: | c1ccc2c(cccc2c1)c1csc(NC(c2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.0824 |
| logD: | 4.6778 |
| logSw: | -5.9861 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.295 |
| InChI Key: | WRFCMXPQEBFYID-UHFFFAOYSA-N |