(5-methylthiophen-2-yl){rel-(3R,4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}methanone
Chemical Structure Depiction of
(5-methylthiophen-2-yl){rel-(3R,4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}methanone
(5-methylthiophen-2-yl){rel-(3R,4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}methanone
Compound characteristics
| Compound ID: | SB56-1013 |
| Compound Name: | (5-methylthiophen-2-yl){rel-(3R,4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}methanone |
| Molecular Weight: | 417.49 |
| Molecular Formula: | C22 H19 N5 O2 S |
| Smiles: | Cc1ccc(C(N2C[C@@H](c3nc(c4ccncc4)no3)[C@@H](C2)c2cccnc2)=O)s1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.7414 |
| logD: | 3.7397 |
| logSw: | -3.7931 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.218 |
| InChI Key: | PGNVJVVVRHZQGT-ZWKOTPCHSA-N |