1-({[5-(4-fluorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}[(furan-2-yl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-({[5-(4-fluorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}[(furan-2-yl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-({[5-(4-fluorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}[(furan-2-yl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V022-6887 |
| Compound Name: | 1-({[5-(4-fluorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}[(furan-2-yl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 489.55 |
| Molecular Formula: | C28 H28 F N3 O4 |
| Salt: | not_available |
| Smiles: | Cn1c(c(CN(CC(COCC#C)O)Cc2ccco2)c(c2ccccc2)n1)Oc1ccc(cc1)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0696 |
| logD: | 3.6839 |
| logSw: | -4.2268 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.696 |
| InChI Key: | BTHVGHDDTUWKNV-QHCPKHFHSA-N |