3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]--hydrogen chloride (1/1)
Chemical Structure Depiction of
3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]--hydrogen chloride (1/1)
3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | S895-0007 |
| Compound Name: | 3'-(propan-2-yl)-5',6',8',9'-tetrahydrospiro[piperidine-4,7'-[1,2,4]triazolo[4,3-a]azepine]--hydrogen chloride (1/1) |
| Molecular Weight: | 284.83 |
| Molecular Formula: | C14 H24 N4 |
| Salt: | HCl |
| Smiles: | CC(C)c1nnc2CCC3(CCNCC3)CCn12 |
| Stereo: | ACHIRAL |
| logP: | 0.5908 |
| logD: | -1.5165 |
| logSw: | -0.7525 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.415 |
| InChI Key: | IQMSGZLIDGISJM-UHFFFAOYSA-N |