2-methyl-1-({[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}[(oxolan-2-yl)methyl]amino)but-3-en-2-ol
Chemical Structure Depiction of
2-methyl-1-({[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}[(oxolan-2-yl)methyl]amino)but-3-en-2-ol
2-methyl-1-({[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}[(oxolan-2-yl)methyl]amino)but-3-en-2-ol
Compound characteristics
| Compound ID: | V021-8796 |
| Compound Name: | 2-methyl-1-({[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}[(oxolan-2-yl)methyl]amino)but-3-en-2-ol |
| Molecular Weight: | 461.6 |
| Molecular Formula: | C28 H35 N3 O3 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)Oc1c(CN(CC2CCCO2)CC(C)(C=C)O)c(c2ccccc2)nn1C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4019 |
| logD: | 4.1279 |
| logSw: | -4.3773 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.958 |
| InChI Key: | UYKMXNCWHIEUAF-UHFFFAOYSA-N |