N-{4-[4-(butan-2-yl)phenyl]-1,3-thiazol-2-yl}-3-nitrobenzamide
Chemical Structure Depiction of
N-{4-[4-(butan-2-yl)phenyl]-1,3-thiazol-2-yl}-3-nitrobenzamide
N-{4-[4-(butan-2-yl)phenyl]-1,3-thiazol-2-yl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y204-1125 |
| Compound Name: | N-{4-[4-(butan-2-yl)phenyl]-1,3-thiazol-2-yl}-3-nitrobenzamide |
| Molecular Weight: | 381.45 |
| Molecular Formula: | C20 H19 N3 O3 S |
| Smiles: | CCC(C)c1ccc(cc1)c1csc(NC(c2cccc(c2)[N+]([O-])=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5122 |
| logD: | 6.5037 |
| logSw: | -5.6676 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.486 |
| InChI Key: | XFYKXVXXFZXCQS-ZDUSSCGKSA-N |