(3,5-dimethyl-1,2-oxazol-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
(3,5-dimethyl-1,2-oxazol-4-yl)[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
(3,5-dimethyl-1,2-oxazol-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: | SB29-0553 |
| Compound Name: | (3,5-dimethyl-1,2-oxazol-4-yl)[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 395.46 |
| Molecular Formula: | C21 H25 N5 O3 |
| Smiles: | Cc1cccc(CO[C@H]2C[C@@H](c3nc(C)[nH]n3)N(C2)C(c2c(C)noc2C)=O)c1 |
| Stereo: | ABSOLUTE |
| logP: | 2.5887 |
| logD: | 2.5873 |
| logSw: | -2.7318 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.058 |
| InChI Key: | FWQYWJKWRGUGPW-MSOLQXFVSA-N |