3-(5-{[4-(dimethylamino)phenyl]methyl}-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)-1-(pyrrolidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(5-{[4-(dimethylamino)phenyl]methyl}-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)-1-(pyrrolidin-1-yl)propan-1-one
3-(5-{[4-(dimethylamino)phenyl]methyl}-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)-1-(pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S586-0168 |
| Compound Name: | 3-(5-{[4-(dimethylamino)phenyl]methyl}-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)-1-(pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 382.51 |
| Molecular Formula: | C21 H30 N6 O |
| Smiles: | CN(C)c1ccc(CN2CCn3c(C2)c(CCC(N2CCCC2)=O)nn3)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.3032 |
| logD: | 0.7525 |
| logSw: | -1.9153 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.007 |
| InChI Key: | JHYCSZMRCDZAIM-UHFFFAOYSA-N |