diethyl 3-methyl-5-[2-(4-nitro-1H-pyrazol-1-yl)acetamido]thiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 3-methyl-5-[2-(4-nitro-1H-pyrazol-1-yl)acetamido]thiophene-2,4-dicarboxylate
diethyl 3-methyl-5-[2-(4-nitro-1H-pyrazol-1-yl)acetamido]thiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 8015-8969 |
| Compound Name: | diethyl 3-methyl-5-[2-(4-nitro-1H-pyrazol-1-yl)acetamido]thiophene-2,4-dicarboxylate |
| Molecular Weight: | 410.4 |
| Molecular Formula: | C16 H18 N4 O7 S |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(Cn1cc(cn1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1018 |
| logD: | 0.1082 |
| logSw: | -2.5479 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.577 |
| InChI Key: | QWTBVGBYHQOFLQ-UHFFFAOYSA-N |