(1-ethyl-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-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-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: | SB29-0587 |
| Compound Name: | (1-ethyl-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: | 394.48 |
| Molecular Formula: | C21 H26 N6 O2 |
| Smiles: | CCn1cc(cn1)C(N1C[C@H](C[C@H]1c1nc(C)[nH]n1)OCc1cccc(C)c1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.3684 |
| logD: | 2.3669 |
| logSw: | -2.5115 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.521 |
| InChI Key: | TUWZKOCSXOHMBO-MOPGFXCFSA-N |