[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl](thiophen-3-yl)methanone
Chemical Structure Depiction of
[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl](thiophen-3-yl)methanone
[(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl](thiophen-3-yl)methanone
Compound characteristics
| Compound ID: | SB29-0505 |
| Compound Name: | [(2S,4S)-4-[(3-methylphenyl)methoxy]-2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl](thiophen-3-yl)methanone |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C20 H22 N4 O2 S |
| Smiles: | Cc1cccc(CO[C@H]2C[C@@H](c3nc(C)[nH]n3)N(C2)C(c2ccsc2)=O)c1 |
| Stereo: | ABSOLUTE |
| logP: | 3.4597 |
| logD: | 3.4583 |
| logSw: | -3.7348 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.038 |
| InChI Key: | QDDFOWPLIKSDTI-MSOLQXFVSA-N |