methyl 4,5-dimethyl-2-[3-(4-nitrophenyl)prop-2-enamido]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 4,5-dimethyl-2-[3-(4-nitrophenyl)prop-2-enamido]thiophene-3-carboxylate
methyl 4,5-dimethyl-2-[3-(4-nitrophenyl)prop-2-enamido]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2260-7973 |
| Compound Name: | methyl 4,5-dimethyl-2-[3-(4-nitrophenyl)prop-2-enamido]thiophene-3-carboxylate |
| Molecular Weight: | 360.39 |
| Molecular Formula: | C17 H16 N2 O5 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(/C=C/c2ccc(cc2)[N+]([O-])=O)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 4.0098 |
| logD: | 1.7924 |
| logSw: | -4.4376 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.466 |
| InChI Key: | BAUGTRWGHLIOCR-UHFFFAOYSA-N |