N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-methyl-3-nitrobenzamide
N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-methyl-3-nitrobenzamide
Compound characteristics
Compound ID: | Y204-0441 |
Compound Name: | N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-methyl-3-nitrobenzamide |
Molecular Weight: | 367.42 |
Molecular Formula: | C19 H17 N3 O3 S |
Smiles: | Cc1ccc(c(C)c1)c1csc(NC(c2ccc(C)c(c2)[N+]([O-])=O)=O)n1 |
Stereo: | ACHIRAL |
logP: | 5.6238 |
logD: | 5.6217 |
logSw: | -5.327 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.185 |
InChI Key: | VRABDAHCKIBAMC-UHFFFAOYSA-N |