3-ethyl-4-[4-(3-methylbutanamido)phenyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate
Chemical Structure Depiction of
3-ethyl-4-[4-(3-methylbutanamido)phenyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate
3-ethyl-4-[4-(3-methylbutanamido)phenyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate
Compound characteristics
| Compound ID: | V015-2478 |
| Compound Name: | 3-ethyl-4-[4-(3-methylbutanamido)phenyl]-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate |
| Molecular Weight: | 419.52 |
| Molecular Formula: | C25 H29 N3 O3 |
| Smiles: | CCc1c(c2ccc(cc2)NC(CC(C)C)=O)c(n(c2ccc(C)cc2)n1)OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3628 |
| logD: | 5.3628 |
| logSw: | -5.4521 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.49 |
| InChI Key: | NNBNHDHVCNZHDN-UHFFFAOYSA-N |