(3S,5S)-1-[(4-methoxy-3-methylphenyl)methyl]-5-(7-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)pyrrolidin-3-ol
Chemical Structure Depiction of
(3S,5S)-1-[(4-methoxy-3-methylphenyl)methyl]-5-(7-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)pyrrolidin-3-ol
(3S,5S)-1-[(4-methoxy-3-methylphenyl)methyl]-5-(7-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)pyrrolidin-3-ol
Compound characteristics
| Compound ID: | S904-1687 |
| Compound Name: | (3S,5S)-1-[(4-methoxy-3-methylphenyl)methyl]-5-(7-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)pyrrolidin-3-ol |
| Molecular Weight: | 357.45 |
| Molecular Formula: | C19 H27 N5 O2 |
| Smiles: | Cc1cc(CN2C[C@H](C[C@H]2c2nnc3CN(C)CCn23)O)ccc1OC |
| Stereo: | ABSOLUTE |
| logP: | 0.6251 |
| logD: | 0.6152 |
| logSw: | -1.6518 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.586 |
| InChI Key: | PZCRNCFTSMZOSC-HOTGVXAUSA-N |