2-anilino-2-oxoethyl 1-methyl-1H-pyrazole-5-carboxylate
Chemical Structure Depiction of
2-anilino-2-oxoethyl 1-methyl-1H-pyrazole-5-carboxylate
2-anilino-2-oxoethyl 1-methyl-1H-pyrazole-5-carboxylate
Compound characteristics
| Compound ID: | Y501-3311 |
| Compound Name: | 2-anilino-2-oxoethyl 1-methyl-1H-pyrazole-5-carboxylate |
| Molecular Weight: | 259.26 |
| Molecular Formula: | C13 H13 N3 O3 |
| Smiles: | Cn1c(ccn1)C(=O)OCC(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7973 |
| logD: | 0.7973 |
| logSw: | -1.7289 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.896 |
| InChI Key: | ASTMTFXOLRGFJJ-UHFFFAOYSA-N |