1-[{[5-(2-methoxyphenoxy)-1-methyl-3-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-(2-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}(2-methylpropyl)amino]-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-[{[5-(2-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}(2-methylpropyl)amino]-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V009-5490 |
| Compound Name: | 1-[{[5-(2-methoxyphenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}(2-methylpropyl)amino]-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 477.6 |
| Molecular Formula: | C28 H35 N3 O4 |
| Salt: | not_available |
| Smiles: | CC(C)CN(CC(COCC#C)O)Cc1c(c2ccccc2)nn(C)c1Oc1ccccc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2596 |
| logD: | 2.4104 |
| logSw: | -4.3898 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.936 |
| InChI Key: | PVBBKWXRICHUSI-QHCPKHFHSA-N |