(3R,5S)-5-{7-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}-1-methylpyrrolidin-3-ol
Chemical Structure Depiction of
(3R,5S)-5-{7-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}-1-methylpyrrolidin-3-ol
(3R,5S)-5-{7-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}-1-methylpyrrolidin-3-ol
Compound characteristics
| Compound ID: | S625-1634 |
| Compound Name: | (3R,5S)-5-{7-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}-1-methylpyrrolidin-3-ol |
| Molecular Weight: | 347.85 |
| Molecular Formula: | C17 H22 Cl N5 O |
| Smiles: | CN1C[C@@H](C[C@H]1c1nnc2CN(CCn12)Cc1ccc(cc1)[Cl])O |
| Stereo: | ABSOLUTE |
| logP: | 0.6669 |
| logD: | 0.6092 |
| logSw: | -1.2688 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.006 |
| InChI Key: | WHQJWGBXJDUEBX-GJZGRUSLSA-N |