1-(benzenesulfonyl)-3'-ethyl-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Chemical Structure Depiction of
1-(benzenesulfonyl)-3'-ethyl-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
1-(benzenesulfonyl)-3'-ethyl-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]
Compound characteristics
| Compound ID: | S895-0722 |
| Compound Name: | 1-(benzenesulfonyl)-3'-ethyl-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine] |
| Molecular Weight: | 374.5 |
| Molecular Formula: | C19 H26 N4 O2 S |
| Smiles: | CCc1nnc2CCC3(CCN(CC3)S(c3ccccc3)(=O)=O)CCn12 |
| Stereo: | ACHIRAL |
| logP: | 2.1247 |
| logD: | 2.1186 |
| logSw: | -2.363 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.95 |
| InChI Key: | WFNJLJPOUJIKNQ-UHFFFAOYSA-N |