(3R,5S)-1-methyl-5-{7-[(4-methyl-1,3-thiazol-5-yl)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-[(4-methyl-1,3-thiazol-5-yl)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-[(4-methyl-1,3-thiazol-5-yl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}pyrrolidin-3-ol
Compound characteristics
| Compound ID: | S625-0457 |
| Compound Name: | (3R,5S)-1-methyl-5-{7-[(4-methyl-1,3-thiazol-5-yl)methyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}pyrrolidin-3-ol |
| Molecular Weight: | 334.44 |
| Molecular Formula: | C15 H22 N6 O S |
| Smiles: | Cc1c(CN2CCn3c(C2)nnc3[C@@H]2C[C@H](CN2C)O)scn1 |
| Stereo: | ABSOLUTE |
| logP: | -0.62 |
| logD: | -0.6777 |
| logSw: | -0.9443 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.211 |
| InChI Key: | MHUIADVUXZYFLT-NEPJUHHUSA-N |