ethyl 4-methyl-2-(4-methyl-3-nitrobenzamido)-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 4-methyl-2-(4-methyl-3-nitrobenzamido)-1,3-thiazole-5-carboxylate
ethyl 4-methyl-2-(4-methyl-3-nitrobenzamido)-1,3-thiazole-5-carboxylate
Compound characteristics
Compound ID: | Y032-3864 |
Compound Name: | ethyl 4-methyl-2-(4-methyl-3-nitrobenzamido)-1,3-thiazole-5-carboxylate |
Molecular Weight: | 349.36 |
Molecular Formula: | C15 H15 N3 O5 S |
Smiles: | CCOC(c1c(C)nc(NC(c2ccc(C)c(c2)[N+]([O-])=O)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 3.5882 |
logD: | 1.7461 |
logSw: | -3.9771 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.787 |
InChI Key: | JSJLUGIRAOUPIV-UHFFFAOYSA-N |