1-[{[5-(4-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}(2-methylpropyl)amino]-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-[{[5-(4-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}(2-methylpropyl)amino]-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-[{[5-(4-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}(2-methylpropyl)amino]-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V004-3950 |
| Compound Name: | 1-[{[5-(4-chlorophenoxy)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}(2-methylpropyl)amino]-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 482.02 |
| Molecular Formula: | C27 H32 Cl N3 O3 |
| Salt: | not_available |
| Smiles: | CC(C)CN(CC(COCC#C)O)Cc1c(C)nn(c2ccccc2)c1Oc1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2918 |
| logD: | 3.883 |
| logSw: | -5.7307 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.876 |
| InChI Key: | QLPZYXVUPYCCQZ-DEOSSOPVSA-N |