1-({[5-(2-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}[(oxolan-2-yl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-({[5-(2-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}[(oxolan-2-yl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-({[5-(2-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}[(oxolan-2-yl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
Compound ID: | V009-1611 |
Compound Name: | 1-({[5-(2-methoxyphenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}[(oxolan-2-yl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
Molecular Weight: | 505.61 |
Molecular Formula: | C29 H35 N3 O5 |
Salt: | not_available |
Smiles: | Cc1c(CN(CC(COCC#C)O)CC2CCCO2)c(n(c2ccccc2)n1)Oc1ccccc1OC |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.5248 |
logD: | 3.3674 |
logSw: | -3.6961 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.976 |
InChI Key: | OTEINCCUAPCDKT-UHFFFAOYSA-N |