(3R,5S)-5-{7-[(4-methoxy-3-methylphenyl)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-methoxy-3-methylphenyl)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-methoxy-3-methylphenyl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}-1-methylpyrrolidin-3-ol
Compound characteristics
| Compound ID: | S625-0490 |
| Compound Name: | (3R,5S)-5-{7-[(4-methoxy-3-methylphenyl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}-1-methylpyrrolidin-3-ol |
| Molecular Weight: | 357.45 |
| Molecular Formula: | C19 H27 N5 O2 |
| Smiles: | Cc1cc(CN2CCn3c(C2)nnc3[C@@H]2C[C@H](CN2C)O)ccc1OC |
| Stereo: | ABSOLUTE |
| logP: | 0.4785 |
| logD: | 0.4208 |
| logSw: | -1.6808 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.636 |
| InChI Key: | NZWMGCRDXXKJQM-HOTGVXAUSA-N |