1-[{[3-ethyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}(propan-2-yl)amino]-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-[{[3-ethyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}(propan-2-yl)amino]-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-[{[3-ethyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}(propan-2-yl)amino]-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V008-1056 |
| Compound Name: | 1-[{[3-ethyl-5-(4-methylphenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}(propan-2-yl)amino]-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 461.6 |
| Molecular Formula: | C28 H35 N3 O3 |
| Salt: | not_available |
| Smiles: | CCc1c(CN(CC(COCC#C)O)C(C)C)c(n(c2ccccc2)n1)Oc1ccc(C)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1525 |
| logD: | 3.5522 |
| logSw: | -5.0233 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.2 |
| InChI Key: | CWQZZGFWIOBREI-DEOSSOPVSA-N |