N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-2-yl)pyrrolidin-3-yl]-5-methylpyridine-2-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-2-yl)pyrrolidin-3-yl]-5-methylpyridine-2-carboxamide
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-2-yl)pyrrolidin-3-yl]-5-methylpyridine-2-carboxamide
Compound characteristics
| Compound ID: | S823-1373 |
| Compound Name: | N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-2-yl)pyrrolidin-3-yl]-5-methylpyridine-2-carboxamide |
| Molecular Weight: | 313.36 |
| Molecular Formula: | C16 H19 N5 O2 |
| Smiles: | Cc1ccc(C(N[C@@H]2CN(C[C@H]2CO)c2ncccn2)=O)nc1 |
| Stereo: | RELATIVE |
| logP: | 1.0511 |
| logD: | 1.051 |
| logSw: | -1.6684 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.875 |
| InChI Key: | JRJSVABKVVQLSN-OCCSQVGLSA-N |