2-methyl-1-{8-(4-methyl-4H-1,2,4-triazol-3-yl)-2-[(3-phenyl-1H-pyrazol-4-yl)methyl]-2,6-diazaspiro[3.4]octan-6-yl}propan-1-one
Chemical Structure Depiction of
2-methyl-1-{8-(4-methyl-4H-1,2,4-triazol-3-yl)-2-[(3-phenyl-1H-pyrazol-4-yl)methyl]-2,6-diazaspiro[3.4]octan-6-yl}propan-1-one
2-methyl-1-{8-(4-methyl-4H-1,2,4-triazol-3-yl)-2-[(3-phenyl-1H-pyrazol-4-yl)methyl]-2,6-diazaspiro[3.4]octan-6-yl}propan-1-one
Compound characteristics
| Compound ID: | SB59-0441 |
| Compound Name: | 2-methyl-1-{8-(4-methyl-4H-1,2,4-triazol-3-yl)-2-[(3-phenyl-1H-pyrazol-4-yl)methyl]-2,6-diazaspiro[3.4]octan-6-yl}propan-1-one |
| Molecular Weight: | 419.53 |
| Molecular Formula: | C23 H29 N7 O |
| Smiles: | CC(C)C(N1CC(c2nncn2C)C2(CN(Cc3c[nH]nc3c3ccccc3)C2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3507 |
| logD: | -4.1918 |
| logSw: | -2.062 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.152 |
| InChI Key: | YOTFXZTYRISXSU-IBGZPJMESA-N |