methyl 1-(2-anilino-2-oxoethyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
methyl 1-(2-anilino-2-oxoethyl)-1H-pyrazole-3-carboxylate
methyl 1-(2-anilino-2-oxoethyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | 8016-7006 |
| Compound Name: | methyl 1-(2-anilino-2-oxoethyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 259.26 |
| Molecular Formula: | C13 H13 N3 O3 |
| Smiles: | COC(c1ccn(CC(Nc2ccccc2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1984 |
| logD: | 1.1984 |
| logSw: | -1.993 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.95 |
| InChI Key: | UVJYARTXSCCCMM-UHFFFAOYSA-N |