methyl 4,5-dimethyl-2-(3-nitrobenzamido)thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 4,5-dimethyl-2-(3-nitrobenzamido)thiophene-3-carboxylate
methyl 4,5-dimethyl-2-(3-nitrobenzamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3366-8769 |
| Compound Name: | methyl 4,5-dimethyl-2-(3-nitrobenzamido)thiophene-3-carboxylate |
| Molecular Weight: | 334.35 |
| Molecular Formula: | C15 H14 N2 O5 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(c2cccc(c2)[N+]([O-])=O)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 3.2455 |
| logD: | -1.5687 |
| logSw: | -3.7157 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.679 |
| InChI Key: | CYPRTSYOIKJHGY-UHFFFAOYSA-N |