3-(1H-benzimidazol-2-yl)-1-[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]propan-1-one
Chemical Structure Depiction of
3-(1H-benzimidazol-2-yl)-1-[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]propan-1-one
3-(1H-benzimidazol-2-yl)-1-[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]propan-1-one
Compound characteristics
| Compound ID: | S824-2380 |
| Compound Name: | 3-(1H-benzimidazol-2-yl)-1-[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]propan-1-one |
| Molecular Weight: | 350.42 |
| Molecular Formula: | C20 H22 N4 O2 |
| Smiles: | C(Cc1nc2ccccc2[nH]1)C(N1C[C@@H](CO)[C@@H](C1)c1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4889 |
| logD: | 1.3816 |
| logSw: | -1.8632 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.146 |
| InChI Key: | SXSBIERLMUEOSG-HOTGVXAUSA-N |