diethyl 3-methyl-5-[(1-methyl-3-nitro-1H-pyrazole-5-carbonyl)amino]thiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 3-methyl-5-[(1-methyl-3-nitro-1H-pyrazole-5-carbonyl)amino]thiophene-2,4-dicarboxylate
diethyl 3-methyl-5-[(1-methyl-3-nitro-1H-pyrazole-5-carbonyl)amino]thiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 8018-4838 |
| Compound Name: | diethyl 3-methyl-5-[(1-methyl-3-nitro-1H-pyrazole-5-carbonyl)amino]thiophene-2,4-dicarboxylate |
| Molecular Weight: | 410.4 |
| Molecular Formula: | C16 H18 N4 O7 S |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(c1cc(nn1C)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9262 |
| logD: | -2.9083 |
| logSw: | -2.7632 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.992 |
| InChI Key: | QXVDIHLKEKNYSW-UHFFFAOYSA-N |