3-[1-(methanesulfonyl)piperidin-2-yl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine
Chemical Structure Depiction of
3-[1-(methanesulfonyl)piperidin-2-yl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine
3-[1-(methanesulfonyl)piperidin-2-yl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine
Compound characteristics
| Compound ID: | S923-0557 |
| Compound Name: | 3-[1-(methanesulfonyl)piperidin-2-yl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepine |
| Molecular Weight: | 299.39 |
| Molecular Formula: | C12 H21 N5 O2 S |
| Smiles: | [H]N1CCc2nnc(C3CCCCN3S(C)(=O)=O)n2CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.7632 |
| logD: | -1.8616 |
| logSw: | -1.3654 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.169 |
| InChI Key: | SYCMFEMTQJGAPO-JTQLQIEISA-N |