3-[1-(dimethylcarbamoyl)piperidin-4-yl]-N-[(3-fluorophenyl)methyl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide
Chemical Structure Depiction of
3-[1-(dimethylcarbamoyl)piperidin-4-yl]-N-[(3-fluorophenyl)methyl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide
3-[1-(dimethylcarbamoyl)piperidin-4-yl]-N-[(3-fluorophenyl)methyl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide
Compound characteristics
| Compound ID: | S903-1576 |
| Compound Name: | 3-[1-(dimethylcarbamoyl)piperidin-4-yl]-N-[(3-fluorophenyl)methyl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide |
| Molecular Weight: | 429.5 |
| Molecular Formula: | C21 H28 F N7 O2 |
| Smiles: | CN(C)C(N1CCC(CC1)c1nnc2CN(CCn12)C(NCc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9728 |
| logD: | 0.9726 |
| logSw: | -1.9555 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.271 |
| InChI Key: | NKXNZKSWILPGRE-UHFFFAOYSA-N |