2,6-difluoro-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-4-yl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
2,6-difluoro-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-4-yl)pyrrolidin-3-yl]benzamide
2,6-difluoro-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-4-yl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | S823-0214 |
| Compound Name: | 2,6-difluoro-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(pyrimidin-4-yl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 334.32 |
| Molecular Formula: | C16 H16 F2 N4 O2 |
| Smiles: | C1[C@H]([C@@H](CN1c1ccncn1)CO)NC(c1c(cccc1F)F)=O |
| Stereo: | RELATIVE |
| logP: | 1.1502 |
| logD: | 1.1496 |
| logSw: | -1.4919 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.029 |
| InChI Key: | ULKPDXVSYHVTCX-MFKMUULPSA-N |