3-cyclopropyl-5-[rel-(3R,4R)-4-(methoxymethyl)-1-(propane-1-sulfonyl)pyrrolidin-3-yl]-1H-1,2,4-triazole
Chemical Structure Depiction of
3-cyclopropyl-5-[rel-(3R,4R)-4-(methoxymethyl)-1-(propane-1-sulfonyl)pyrrolidin-3-yl]-1H-1,2,4-triazole
3-cyclopropyl-5-[rel-(3R,4R)-4-(methoxymethyl)-1-(propane-1-sulfonyl)pyrrolidin-3-yl]-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | SB32-0727 |
| Compound Name: | 3-cyclopropyl-5-[rel-(3R,4R)-4-(methoxymethyl)-1-(propane-1-sulfonyl)pyrrolidin-3-yl]-1H-1,2,4-triazole |
| Molecular Weight: | 328.43 |
| Molecular Formula: | C14 H24 N4 O3 S |
| Smiles: | CCCS(N1C[C@@H](COC)[C@@H](C1)c1nc(C2CC2)n[nH]1)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.334 |
| logD: | 1.332 |
| logSw: | -2.0776 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.808 |
| InChI Key: | ARGIYZUNOUMZGL-NWDGAFQWSA-N |