methyl 1-[2-(2,4-dimethylanilino)-2-oxoethyl]-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
methyl 1-[2-(2,4-dimethylanilino)-2-oxoethyl]-1H-pyrazole-3-carboxylate
methyl 1-[2-(2,4-dimethylanilino)-2-oxoethyl]-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | 8016-8899 |
| Compound Name: | methyl 1-[2-(2,4-dimethylanilino)-2-oxoethyl]-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 287.32 |
| Molecular Formula: | C15 H17 N3 O3 |
| Smiles: | Cc1ccc(c(C)c1)NC(Cn1ccc(C(=O)OC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8728 |
| logD: | 1.8728 |
| logSw: | -2.5071 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.252 |
| InChI Key: | GOQXJDLUODMPGB-UHFFFAOYSA-N |