(2-ethoxyphenyl)[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
(2-ethoxyphenyl)[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
(2-ethoxyphenyl)[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | SB29-0530 |
| Compound Name: | (2-ethoxyphenyl)[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C24 H28 N4 O3 |
| Smiles: | CCOc1ccccc1C(N1C[C@H](C[C@H]1c1nc(C)[nH]n1)OCc1cccc(C)c1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.8955 |
| logD: | 3.8941 |
| logSw: | -3.9637 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.23 |
| InChI Key: | CMQXEFZRQXCXGU-CTNGQTDRSA-N |