3-cyclopropyl-5-[rel-(3R,4R)-1-(3-methoxybenzene-1-sulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-1H-1,2,4-triazole
Chemical Structure Depiction of
3-cyclopropyl-5-[rel-(3R,4R)-1-(3-methoxybenzene-1-sulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-1H-1,2,4-triazole
3-cyclopropyl-5-[rel-(3R,4R)-1-(3-methoxybenzene-1-sulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | SB32-0699 |
| Compound Name: | 3-cyclopropyl-5-[rel-(3R,4R)-1-(3-methoxybenzene-1-sulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-1H-1,2,4-triazole |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C18 H24 N4 O4 S |
| Smiles: | COC[C@@H]1CN(C[C@H]1c1nc(C2CC2)n[nH]1)S(c1cccc(c1)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3146 |
| logD: | 2.3131 |
| logSw: | -2.8408 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.186 |
| InChI Key: | SLVSSVVNZAXBFA-XJKSGUPXSA-N |