1-(methanesulfonyl)-3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Chemical Structure Depiction of
1-(methanesulfonyl)-3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
1-(methanesulfonyl)-3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Compound characteristics
| Compound ID: | S895-1217 |
| Compound Name: | 1-(methanesulfonyl)-3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine] |
| Molecular Weight: | 326.46 |
| Molecular Formula: | C15 H26 N4 O2 S |
| Smiles: | CC(C)c1nnc2CCC3(CCN(CC3)S(C)(=O)=O)CCn12 |
| Stereo: | ACHIRAL |
| logP: | 1.1914 |
| logD: | 1.1716 |
| logSw: | -1.5838 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.738 |
| InChI Key: | CJZMLGVENWIQHJ-UHFFFAOYSA-N |