(3R,5S)-1-methyl-5-(7-{[2-(trifluoromethyl)phenyl]methyl}-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)pyrrolidin-3-ol
Chemical Structure Depiction of
(3R,5S)-1-methyl-5-(7-{[2-(trifluoromethyl)phenyl]methyl}-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)pyrrolidin-3-ol
(3R,5S)-1-methyl-5-(7-{[2-(trifluoromethyl)phenyl]methyl}-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)pyrrolidin-3-ol
Compound characteristics
| Compound ID: | S625-2007 |
| Compound Name: | (3R,5S)-1-methyl-5-(7-{[2-(trifluoromethyl)phenyl]methyl}-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)pyrrolidin-3-ol |
| Molecular Weight: | 381.4 |
| Molecular Formula: | C18 H22 F3 N5 O |
| Smiles: | CN1C[C@@H](C[C@H]1c1nnc2CN(CCn12)Cc1ccccc1C(F)(F)F)O |
| Stereo: | ABSOLUTE |
| logP: | 1.0073 |
| logD: | 0.9496 |
| logSw: | -1.9529 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.006 |
| InChI Key: | GSZCMIKOZXOJTK-ZFWWWQNUSA-N |