6-benzyl-2-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2,6-diazaspiro[3.4]octane
Chemical Structure Depiction of
6-benzyl-2-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2,6-diazaspiro[3.4]octane
6-benzyl-2-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2,6-diazaspiro[3.4]octane
Compound characteristics
| Compound ID: | SC55-0555 |
| Compound Name: | 6-benzyl-2-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-8-[3-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-2,6-diazaspiro[3.4]octane |
| Molecular Weight: | 447.63 |
| Molecular Formula: | C26 H37 N7 |
| Smiles: | CCn1c(C)c(CN2CC3(CN(CC3c3nc(C(C)C)n[nH]3)Cc3ccccc3)C2)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9551 |
| logD: | -4.623 |
| logSw: | -2.9638 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.926 |
| InChI Key: | QQZRGRZWRCSIMO-HSZRJFAPSA-N |