N,N-diethyl-3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide
Chemical Structure Depiction of
N,N-diethyl-3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide
N,N-diethyl-3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide
Compound characteristics
| Compound ID: | S903-1685 |
| Compound Name: | N,N-diethyl-3-[1-(propane-2-sulfonyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide |
| Molecular Weight: | 412.55 |
| Molecular Formula: | C18 H32 N6 O3 S |
| Smiles: | CCN(CC)C(N1CCn2c(C1)nnc2C1CCN(CC1)S(C(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1058 |
| logD: | 1.1055 |
| logSw: | -1.5794 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.393 |
| InChI Key: | KVSWIERJQCVTHG-UHFFFAOYSA-N |