1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-2-(pyridin-3-yl)ethan-1-one
Chemical Structure Depiction of
1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-2-(pyridin-3-yl)ethan-1-one
1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-2-(pyridin-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | S823-4275 |
| Compound Name: | 1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-2-(pyridin-3-yl)ethan-1-one |
| Molecular Weight: | 263.34 |
| Molecular Formula: | C14 H21 N3 O2 |
| Smiles: | CN(C)[C@@H]1CN(C[C@H]1CO)C(Cc1cccnc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.5721 |
| logD: | -2.3754 |
| logSw: | -0.2742 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.136 |
| InChI Key: | FXBNZMOTRSMVQV-QWHCGFSZSA-N |