1-({[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(4-fluorophenyl)methyl]amino)-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-({[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(4-fluorophenyl)methyl]amino)-3-[(prop-2-en-1-yl)oxy]propan-2-ol
1-({[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(4-fluorophenyl)methyl]amino)-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V022-0939 |
| Compound Name: | 1-({[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(4-fluorophenyl)methyl]amino)-3-[(prop-2-en-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C24 H27 F N2 O5 |
| Salt: | not_available |
| Smiles: | C=CCOCC(CN(CC1CC(c2ccc3c(c2)OCO3)=NO1)Cc1ccc(cc1)F)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5789 |
| logD: | 3.5703 |
| logSw: | -3.5461 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.874 |
| InChI Key: | MOXUAYSXJSMMAN-UHFFFAOYSA-N |