1-({[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(2-fluorophenyl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-({[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(2-fluorophenyl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-({[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(2-fluorophenyl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V003-8665 |
| Compound Name: | 1-({[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(2-fluorophenyl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 465.35 |
| Molecular Formula: | C23 H23 Cl2 F N2 O3 |
| Salt: | not_available |
| Smiles: | C#CCOCC(CN(CC1CC(c2ccc(c(c2)[Cl])[Cl])=NO1)Cc1ccccc1F)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9627 |
| logD: | 4.9594 |
| logSw: | -5.0935 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.758 |
| InChI Key: | CGLWOKPDZXVMIZ-UHFFFAOYSA-N |