2-(4-methylanilino)-2-oxoethyl 4-chloro-1-methyl-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
2-(4-methylanilino)-2-oxoethyl 4-chloro-1-methyl-1H-pyrazole-3-carboxylate
2-(4-methylanilino)-2-oxoethyl 4-chloro-1-methyl-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | Y504-5103 |
| Compound Name: | 2-(4-methylanilino)-2-oxoethyl 4-chloro-1-methyl-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 307.73 |
| Molecular Formula: | C14 H14 Cl N3 O3 |
| Smiles: | Cc1ccc(cc1)NC(COC(c1c(cn(C)n1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0671 |
| logD: | 2.067 |
| logSw: | -2.8416 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.601 |
| InChI Key: | RRIVKRCIRNPODT-UHFFFAOYSA-N |