3-cyclopropyl-5-{rel-(3R,4R)-4-(methoxymethyl)-1-[(4-methylphenyl)methanesulfonyl]pyrrolidin-3-yl}-1H-1,2,4-triazole
Chemical Structure Depiction of
3-cyclopropyl-5-{rel-(3R,4R)-4-(methoxymethyl)-1-[(4-methylphenyl)methanesulfonyl]pyrrolidin-3-yl}-1H-1,2,4-triazole
3-cyclopropyl-5-{rel-(3R,4R)-4-(methoxymethyl)-1-[(4-methylphenyl)methanesulfonyl]pyrrolidin-3-yl}-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | SB32-0761 |
| Compound Name: | 3-cyclopropyl-5-{rel-(3R,4R)-4-(methoxymethyl)-1-[(4-methylphenyl)methanesulfonyl]pyrrolidin-3-yl}-1H-1,2,4-triazole |
| Molecular Weight: | 390.5 |
| Molecular Formula: | C19 H26 N4 O3 S |
| Smiles: | Cc1ccc(CS(N2C[C@@H](COC)[C@@H](C2)c2nc(C3CC3)n[nH]2)(=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3755 |
| logD: | 2.3735 |
| logSw: | -2.9267 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.537 |
| InChI Key: | FOWSDSCSZOQCJA-DLBZAZTESA-N |