1-[rel-(3R,4R)-3-(methoxymethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]-2-methylpropan-1-one
Chemical Structure Depiction of
1-[rel-(3R,4R)-3-(methoxymethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]-2-methylpropan-1-one
1-[rel-(3R,4R)-3-(methoxymethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]-2-methylpropan-1-one
Compound characteristics
| Compound ID: | SB32-0114 |
| Compound Name: | 1-[rel-(3R,4R)-3-(methoxymethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]-2-methylpropan-1-one |
| Molecular Weight: | 266.34 |
| Molecular Formula: | C13 H22 N4 O2 |
| Smiles: | CC(C)C(N1C[C@@H](COC)[C@@H](C1)c1nc(C)n[nH]1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7539 |
| logD: | 0.7534 |
| logSw: | -1.7123 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.213 |
| InChI Key: | JBTZUNWYUKOMPO-WDEREUQCSA-N |