3-(1H-imidazol-1-yl)-1-{3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}propan-1-one
Chemical Structure Depiction of
3-(1H-imidazol-1-yl)-1-{3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}propan-1-one
3-(1H-imidazol-1-yl)-1-{3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}propan-1-one
Compound characteristics
| Compound ID: | S903-0900 |
| Compound Name: | 3-(1H-imidazol-1-yl)-1-{3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}propan-1-one |
| Molecular Weight: | 435.55 |
| Molecular Formula: | C19 H29 N7 O3 S |
| Smiles: | CC(C)S(N1CCC(CC1)c1nnc2CN(CCn12)C(CCn1ccnc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.4359 |
| logD: | -0.5228 |
| logSw: | -1.0973 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 85.577 |
| InChI Key: | GEYQSCDIBDAKTB-UHFFFAOYSA-N |