6-benzyl-2-(oxan-4-yl)-8-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2,6-diazaspiro[3.4]octane--hydrogen chloride (1/1)
Chemical Structure Depiction of
6-benzyl-2-(oxan-4-yl)-8-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2,6-diazaspiro[3.4]octane--hydrogen chloride (1/1)
6-benzyl-2-(oxan-4-yl)-8-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2,6-diazaspiro[3.4]octane--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | SC55-0533 |
| Compound Name: | 6-benzyl-2-(oxan-4-yl)-8-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2,6-diazaspiro[3.4]octane--hydrogen chloride (1/1) |
| Molecular Weight: | 432.01 |
| Molecular Formula: | C23 H33 N5 O |
| Salt: | HCl |
| Smiles: | CC(C)c1nc(C2CN(Cc3ccccc3)CC23CN(C3)C2CCOCC2)[nH]n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6726 |
| logD: | -1.9553 |
| logSw: | -2.7248 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.109 |
| InChI Key: | QTSYRWWIZDNQDL-HXUWFJFHSA-N |