1-(cyclopropyl{[1-methyl-5-(4-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-(cyclopropyl{[1-methyl-5-(4-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-(cyclopropyl{[1-methyl-5-(4-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V016-5252 |
| Compound Name: | 1-(cyclopropyl{[1-methyl-5-(4-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C27 H31 N3 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)Oc1c(CN(CC(COCC#C)O)C2CC2)c(c2ccccc2)nn1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1086 |
| logD: | 3.4584 |
| logSw: | -4.2347 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.415 |
| InChI Key: | KXJGAHNTXMHJCP-QHCPKHFHSA-N |