1-([(furan-2-yl)methyl]{[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-([(furan-2-yl)methyl]{[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-([(furan-2-yl)methyl]{[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V022-6379 |
| Compound Name: | 1-([(furan-2-yl)methyl]{[1-methyl-5-(3-methylphenoxy)-3-phenyl-1H-pyrazol-4-yl]methyl}amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 485.58 |
| Molecular Formula: | C29 H31 N3 O4 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)Oc1c(CN(CC(COCC#C)O)Cc2ccco2)c(c2ccccc2)nn1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4458 |
| logD: | 4.0601 |
| logSw: | -4.4958 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.696 |
| InChI Key: | DOQRPODKQQZTIP-DEOSSOPVSA-N |