1-{benzyl[(3-methyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-{benzyl[(3-methyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-{benzyl[(3-methyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V004-3984 |
| Compound Name: | 1-{benzyl[(3-methyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 481.59 |
| Molecular Formula: | C30 H31 N3 O3 |
| Salt: | not_available |
| Smiles: | Cc1c(CN(CC(COCC#C)O)Cc2ccccc2)c(n(c2ccccc2)n1)Oc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9341 |
| logD: | 4.5137 |
| logSw: | -4.6169 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.604 |
| InChI Key: | MHSZIBUDAQZIBE-MHZLTWQESA-N |