3-({[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(2-fluorophenyl)methyl]amino)-2-hydroxypropyl butanoate
Chemical Structure Depiction of
3-({[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(2-fluorophenyl)methyl]amino)-2-hydroxypropyl butanoate
3-({[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(2-fluorophenyl)methyl]amino)-2-hydroxypropyl butanoate
Compound characteristics
| Compound ID: | V003-8653 |
| Compound Name: | 3-({[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(2-fluorophenyl)methyl]amino)-2-hydroxypropyl butanoate |
| Molecular Weight: | 497.39 |
| Molecular Formula: | C24 H27 Cl2 F N2 O4 |
| Salt: | not_available |
| Smiles: | CCCC(=O)OCC(CN(CC1CC(c2ccc(c(c2)[Cl])[Cl])=NO1)Cc1ccccc1F)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8218 |
| logD: | 5.7841 |
| logSw: | -5.8257 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.94 |
| InChI Key: | KUGYQGVEARKLOY-UHFFFAOYSA-N |