dimethyl 2-[(4-chloro-1-methyl-1H-pyrazole-5-carbonyl)amino]benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-[(4-chloro-1-methyl-1H-pyrazole-5-carbonyl)amino]benzene-1,4-dicarboxylate
dimethyl 2-[(4-chloro-1-methyl-1H-pyrazole-5-carbonyl)amino]benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | Y501-3663 |
| Compound Name: | dimethyl 2-[(4-chloro-1-methyl-1H-pyrazole-5-carbonyl)amino]benzene-1,4-dicarboxylate |
| Molecular Weight: | 351.74 |
| Molecular Formula: | C15 H14 Cl N3 O5 |
| Smiles: | Cn1c(C(Nc2cc(ccc2C(=O)OC)C(=O)OC)=O)c(cn1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.1616 |
| logD: | 0.4747 |
| logSw: | -3.4482 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.495 |
| InChI Key: | TZABBFBXHYHEAA-UHFFFAOYSA-N |