(1-ethyl-3-methyl-1H-pyrazol-4-yl)[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
(1-ethyl-3-methyl-1H-pyrazol-4-yl)[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
(1-ethyl-3-methyl-1H-pyrazol-4-yl)[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | SB29-0589 |
| Compound Name: | (1-ethyl-3-methyl-1H-pyrazol-4-yl)[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 408.5 |
| Molecular Formula: | C22 H28 N6 O2 |
| Smiles: | CCn1cc(C(N2C[C@H](C[C@H]2c2nc(C)[nH]n2)OCc2cccc(C)c2)=O)c(C)n1 |
| Stereo: | ABSOLUTE |
| logP: | 2.5084 |
| logD: | 2.507 |
| logSw: | -2.6748 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.874 |
| InChI Key: | HINOXJDRSILABJ-QUCCMNQESA-N |