{3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(thiophen-2-yl)methanone
Chemical Structure Depiction of
{3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(thiophen-2-yl)methanone
{3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | S903-0740 |
| Compound Name: | {3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(thiophen-2-yl)methanone |
| Molecular Weight: | 423.55 |
| Molecular Formula: | C18 H25 N5 O3 S2 |
| Smiles: | CC(C)S(N1CCC(CC1)c1nnc2CN(CCn12)C(c1cccs1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.34 |
| logD: | 1.34 |
| logSw: | -2.2181 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.322 |
| InChI Key: | MFSSYNIJTCQXKH-UHFFFAOYSA-N |