2-[rel-(3R,4R)-4-(methoxymethyl)-1-(3-methylbenzene-1-sulfonyl)pyrrolidin-3-yl]pyridine
Chemical Structure Depiction of
2-[rel-(3R,4R)-4-(methoxymethyl)-1-(3-methylbenzene-1-sulfonyl)pyrrolidin-3-yl]pyridine
2-[rel-(3R,4R)-4-(methoxymethyl)-1-(3-methylbenzene-1-sulfonyl)pyrrolidin-3-yl]pyridine
Compound characteristics
| Compound ID: | S831-2192 |
| Compound Name: | 2-[rel-(3R,4R)-4-(methoxymethyl)-1-(3-methylbenzene-1-sulfonyl)pyrrolidin-3-yl]pyridine |
| Molecular Weight: | 346.45 |
| Molecular Formula: | C18 H22 N2 O3 S |
| Smiles: | Cc1cccc(c1)S(N1C[C@@H](COC)[C@@H](C1)c1ccccn1)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.5123 |
| logD: | 2.5122 |
| logSw: | -2.8638 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.382 |
| InChI Key: | BLPCVTOSOFIXQM-DOTOQJQBSA-N |