ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(3-methylphenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(3-methylphenyl)-1H-pyrazole-3-carboxylate
ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(3-methylphenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V003-0141 |
| Compound Name: | ethyl 5-[3-(2-ethylbutanamido)phenyl]-1-(3-methylphenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 419.52 |
| Molecular Formula: | C25 H29 N3 O3 |
| Smiles: | CCC(CC)C(Nc1cccc(c1)c1cc(C(=O)OCC)nn1c1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8363 |
| logD: | 5.8363 |
| logSw: | -5.3996 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.178 |
| InChI Key: | SPQVOJRRHWACLV-UHFFFAOYSA-N |