[(2S,4S)-4-methoxy-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl][1-(4-methoxyphenyl)cyclohexyl]methanone
Chemical Structure Depiction of
[(2S,4S)-4-methoxy-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl][1-(4-methoxyphenyl)cyclohexyl]methanone
[(2S,4S)-4-methoxy-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl][1-(4-methoxyphenyl)cyclohexyl]methanone
Compound characteristics
| Compound ID: | SB29-0185 |
| Compound Name: | [(2S,4S)-4-methoxy-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl][1-(4-methoxyphenyl)cyclohexyl]methanone |
| Molecular Weight: | 398.5 |
| Molecular Formula: | C22 H30 N4 O3 |
| Smiles: | Cc1nc([C@@H]2C[C@@H](CN2C(C2(CCCCC2)c2ccc(cc2)OC)=O)OC)n[nH]1 |
| Stereo: | ABSOLUTE |
| logP: | 3.1574 |
| logD: | 3.156 |
| logSw: | -3.2404 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.8 |
| InChI Key: | FUKYDIADJKLPRQ-MOPGFXCFSA-N |