2-(2-chloroanilino)-2-oxoethyl 1-methyl-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
2-(2-chloroanilino)-2-oxoethyl 1-methyl-1H-pyrazole-3-carboxylate
2-(2-chloroanilino)-2-oxoethyl 1-methyl-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | Y501-3304 |
| Compound Name: | 2-(2-chloroanilino)-2-oxoethyl 1-methyl-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 293.71 |
| Molecular Formula: | C13 H12 Cl N3 O3 |
| Smiles: | Cn1ccc(C(=O)OCC(Nc2ccccc2[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.9985 |
| logD: | 0.9984 |
| logSw: | -2.284 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.24 |
| InChI Key: | HVPLZBCWKUTEHL-UHFFFAOYSA-N |