N-benzyl-3-[1-(dimethylcarbamoyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide
Chemical Structure Depiction of
N-benzyl-3-[1-(dimethylcarbamoyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide
N-benzyl-3-[1-(dimethylcarbamoyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide
Compound characteristics
| Compound ID: | S903-1501 |
| Compound Name: | N-benzyl-3-[1-(dimethylcarbamoyl)piperidin-4-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide |
| Molecular Weight: | 411.51 |
| Molecular Formula: | C21 H29 N7 O2 |
| Smiles: | CN(C)C(N1CCC(CC1)c1nnc2CN(CCn12)C(NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8087 |
| logD: | 0.8085 |
| logSw: | -1.7386 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.271 |
| InChI Key: | MRJZFKZXFJTBQF-UHFFFAOYSA-N |