dimethyl 3-methyl-5-[3-(1-methyl-1H-pyrazol-4-yl)prop-2-enamido]thiophene-2,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 3-methyl-5-[3-(1-methyl-1H-pyrazol-4-yl)prop-2-enamido]thiophene-2,4-dicarboxylate
dimethyl 3-methyl-5-[3-(1-methyl-1H-pyrazol-4-yl)prop-2-enamido]thiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | Y500-7930 |
| Compound Name: | dimethyl 3-methyl-5-[3-(1-methyl-1H-pyrazol-4-yl)prop-2-enamido]thiophene-2,4-dicarboxylate |
| Molecular Weight: | 363.39 |
| Molecular Formula: | C16 H17 N3 O5 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(/C=C/c2cnn(C)c2)=O)sc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.5635 |
| logD: | -0.5457 |
| logSw: | -2.283 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.067 |
| InChI Key: | VSGLHFUEAGDVAX-UHFFFAOYSA-N |