1-({[5-(2-fluorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}[(oxolan-2-yl)methyl]amino)-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-({[5-(2-fluorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}[(oxolan-2-yl)methyl]amino)-3-[(prop-2-en-1-yl)oxy]propan-2-ol
1-({[5-(2-fluorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}[(oxolan-2-yl)methyl]amino)-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V009-2102 |
| Compound Name: | 1-({[5-(2-fluorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}[(oxolan-2-yl)methyl]amino)-3-[(prop-2-en-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 495.59 |
| Molecular Formula: | C28 H34 F N3 O4 |
| Salt: | not_available |
| Smiles: | Cn1c(c(CN(CC(COCC=C)O)CC2CCCO2)c(c2ccccc2)n1)Oc1ccccc1F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5096 |
| logD: | 2.8839 |
| logSw: | -3.7949 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.689 |
| InChI Key: | VOBLLEBQDQYVLJ-UHFFFAOYSA-N |