dimethyl 3-(3,6-dichloropyridine-2-carbonyl)-1H-pyrazole-4,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 3-(3,6-dichloropyridine-2-carbonyl)-1H-pyrazole-4,5-dicarboxylate
dimethyl 3-(3,6-dichloropyridine-2-carbonyl)-1H-pyrazole-4,5-dicarboxylate
Compound characteristics
| Compound ID: | 8012-6231 |
| Compound Name: | dimethyl 3-(3,6-dichloropyridine-2-carbonyl)-1H-pyrazole-4,5-dicarboxylate |
| Molecular Weight: | 358.13 |
| Molecular Formula: | C13 H9 Cl2 N3 O5 |
| Smiles: | COC(c1c(C(c2c(ccc(n2)[Cl])[Cl])=O)n[nH]c1C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8002 |
| logD: | 1.6651 |
| logSw: | -2.9915 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.609 |
| InChI Key: | KQLLIUUHNFZQRW-UHFFFAOYSA-N |