1-[{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}(2-methylpropyl)amino]-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-[{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}(2-methylpropyl)amino]-3-[(prop-2-en-1-yl)oxy]propan-2-ol
1-[{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}(2-methylpropyl)amino]-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V023-0550 |
| Compound Name: | 1-[{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}(2-methylpropyl)amino]-3-[(prop-2-en-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 484.04 |
| Molecular Formula: | C27 H34 Cl N3 O3 |
| Salt: | not_available |
| Smiles: | CC(C)CN(CC(COCC=C)O)Cc1c(C)nn(c2cccc(c2)[Cl])c1Oc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6677 |
| logD: | 3.8529 |
| logSw: | -5.6509 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.876 |
| InChI Key: | GHTQNTRVSQBXMZ-DEOSSOPVSA-N |