ethyl 4,5-dimethyl-2-(3-methyl-4-nitrobenzamido)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4,5-dimethyl-2-(3-methyl-4-nitrobenzamido)thiophene-3-carboxylate
ethyl 4,5-dimethyl-2-(3-methyl-4-nitrobenzamido)thiophene-3-carboxylate
Compound characteristics
Compound ID: | 3772-2120 |
Compound Name: | ethyl 4,5-dimethyl-2-(3-methyl-4-nitrobenzamido)thiophene-3-carboxylate |
Molecular Weight: | 362.4 |
Molecular Formula: | C17 H18 N2 O5 S |
Smiles: | CCOC(c1c(C)c(C)sc1NC(c1ccc(c(C)c1)[N+]([O-])=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1002 |
logD: | -0.2853 |
logSw: | -4.4043 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.958 |
InChI Key: | SCOFWWJZGWZWCF-UHFFFAOYSA-N |