ethyl 5-acetyl-2-[2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamido]-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-acetyl-2-[2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamido]-4-methylthiophene-3-carboxylate
ethyl 5-acetyl-2-[2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamido]-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8017-5770 |
| Compound Name: | ethyl 5-acetyl-2-[2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamido]-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 489.33 |
| Molecular Formula: | C17 H20 I N3 O4 S |
| Smiles: | CCOC(c1c(C)c(C(C)=O)sc1NC(Cn1c(C)c(c(C)n1)I)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1869 |
| logD: | -0.7096 |
| logSw: | -2.4978 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.044 |
| InChI Key: | DLUYNZNXUOLCHM-UHFFFAOYSA-N |