N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-2-nitrobenzamide
Chemical Structure Depiction of
N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-2-nitrobenzamide
N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-2-nitrobenzamide
Compound characteristics
Compound ID: | 0671-0140 |
Compound Name: | N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)-2-nitrobenzamide |
Molecular Weight: | 319.38 |
Molecular Formula: | C15 H17 N3 O3 S |
Smiles: | Cc1c(C(C)(C)C)sc(NC(c2ccccc2[N+]([O-])=O)=O)n1 |
Stereo: | ACHIRAL |
logP: | 4.0421 |
logD: | 0.8367 |
logSw: | -4.307 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.034 |
InChI Key: | JLDZCJMMTANNEW-UHFFFAOYSA-N |