N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(thian-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(thian-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(thian-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide
Compound characteristics
| Compound ID: | S823-6938 |
| Compound Name: | N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(thian-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide |
| Molecular Weight: | 322.43 |
| Molecular Formula: | C15 H22 N4 O2 S |
| Smiles: | C1CSCCC1N1C[C@H]([C@@H](C1)CO)NC(c1cnccn1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.3755 |
| logD: | -3.313 |
| logSw: | -1.7367 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.774 |
| InChI Key: | KYWGOINKLRHSSB-SMDDNHRTSA-N |