(3R,5S)-5-{7-[(5-methoxy-1H-indol-3-yl)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-[(5-methoxy-1H-indol-3-yl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}-1-methylpyrrolidin-3-ol
(3R,5S)-5-{7-[(5-methoxy-1H-indol-3-yl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}-1-methylpyrrolidin-3-ol
Compound characteristics
| Compound ID: | S625-0459 |
| Compound Name: | (3R,5S)-5-{7-[(5-methoxy-1H-indol-3-yl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}-1-methylpyrrolidin-3-ol |
| Molecular Weight: | 382.46 |
| Molecular Formula: | C20 H26 N6 O2 |
| Smiles: | CN1C[C@@H](C[C@H]1c1nnc2CN(CCn12)Cc1c[nH]c2ccc(cc12)OC)O |
| Stereo: | ABSOLUTE |
| logP: | 0.2873 |
| logD: | 0.2296 |
| logSw: | -1.9661 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.421 |
| InChI Key: | WMXPCFOAAFGVFB-KSSFIOAISA-N |