1-(benzyl{[1-methyl-5-(4-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}amino)-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-(benzyl{[1-methyl-5-(4-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}amino)-3-[(prop-2-en-1-yl)oxy]propan-2-ol
1-(benzyl{[1-methyl-5-(4-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}amino)-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V022-9245 |
| Compound Name: | 1-(benzyl{[1-methyl-5-(4-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}amino)-3-[(prop-2-en-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 497.64 |
| Molecular Formula: | C31 H35 N3 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)Oc1c(CN(CC(COCC=C)O)Cc2ccccc2)c(c2ccccc2)nn1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2996 |
| logD: | 4.1839 |
| logSw: | -5.3576 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.948 |
| InChI Key: | KIOBHJNAIRUJRL-MHZLTWQESA-N |