(3-fluoro-4-methoxyphenyl){3-[(2S,4S)-4-hydroxy-1-(propan-2-yl)pyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}methanone
Chemical Structure Depiction of
(3-fluoro-4-methoxyphenyl){3-[(2S,4S)-4-hydroxy-1-(propan-2-yl)pyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}methanone
(3-fluoro-4-methoxyphenyl){3-[(2S,4S)-4-hydroxy-1-(propan-2-yl)pyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}methanone
Compound characteristics
| Compound ID: | S904-1428 |
| Compound Name: | (3-fluoro-4-methoxyphenyl){3-[(2S,4S)-4-hydroxy-1-(propan-2-yl)pyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}methanone |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C20 H26 F N5 O3 |
| Smiles: | CC(C)N1C[C@H](C[C@H]1c1nnc2CN(CCn12)C(c1ccc(c(c1)F)OC)=O)O |
| Stereo: | ABSOLUTE |
| logP: | 0.7251 |
| logD: | 0.5885 |
| logSw: | -1.8233 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.723 |
| InChI Key: | JOCQXSZVVOOGDA-ZBFHGGJFSA-N |