(1-ethyl-5-methyl-1H-pyrazol-4-yl){3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}methanone
Chemical Structure Depiction of
(1-ethyl-5-methyl-1H-pyrazol-4-yl){3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}methanone
(1-ethyl-5-methyl-1H-pyrazol-4-yl){3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}methanone
Compound characteristics
| Compound ID: | S903-0872 |
| Compound Name: | (1-ethyl-5-methyl-1H-pyrazol-4-yl){3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}methanone |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C20 H31 N7 O3 S |
| Smiles: | CCn1c(C)c(cn1)C(N1CCn2c(C1)nnc2C1CCN(CC1)S(C(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3897 |
| logD: | 0.3897 |
| logSw: | -1.6821 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 87.229 |
| InChI Key: | KGHXGGFLKCIQBJ-UHFFFAOYSA-N |