ethyl 4-cyano-3-methyl-5-[3-(1-methyl-1H-pyrazol-4-yl)prop-2-enamido]thiophene-2-carboxylate
Chemical Structure Depiction of
ethyl 4-cyano-3-methyl-5-[3-(1-methyl-1H-pyrazol-4-yl)prop-2-enamido]thiophene-2-carboxylate
ethyl 4-cyano-3-methyl-5-[3-(1-methyl-1H-pyrazol-4-yl)prop-2-enamido]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y500-8184 |
| Compound Name: | ethyl 4-cyano-3-methyl-5-[3-(1-methyl-1H-pyrazol-4-yl)prop-2-enamido]thiophene-2-carboxylate |
| Molecular Weight: | 344.39 |
| Molecular Formula: | C16 H16 N4 O3 S |
| Smiles: | CCOC(c1c(C)c(C#N)c(NC(/C=C/c2cnn(C)c2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9031 |
| logD: | 0.7924 |
| logSw: | -2.519 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.53 |
| InChI Key: | HOUVSWGUGPMDFV-UHFFFAOYSA-N |