(2-ethoxyphenyl)[(2S,4S)-4-methoxy-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
(2-ethoxyphenyl)[(2S,4S)-4-methoxy-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
(2-ethoxyphenyl)[(2S,4S)-4-methoxy-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | SB29-0132 |
| Compound Name: | (2-ethoxyphenyl)[(2S,4S)-4-methoxy-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 330.38 |
| Molecular Formula: | C17 H22 N4 O3 |
| Smiles: | CCOc1ccccc1C(N1C[C@H](C[C@H]1c1nc(C)[nH]n1)OC)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.6823 |
| logD: | 1.6809 |
| logSw: | -2.4601 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.546 |
| InChI Key: | MIRFHMNJJKACBU-OCCSQVGLSA-N |