1-({[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(2-chlorophenyl)methyl]amino)-3-(benzyloxy)propan-2-ol
Chemical Structure Depiction of
1-({[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(2-chlorophenyl)methyl]amino)-3-(benzyloxy)propan-2-ol
1-({[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(2-chlorophenyl)methyl]amino)-3-(benzyloxy)propan-2-ol
Compound characteristics
| Compound ID: | V022-0887 |
| Compound Name: | 1-({[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(2-chlorophenyl)methyl]amino)-3-(benzyloxy)propan-2-ol |
| Molecular Weight: | 509 |
| Molecular Formula: | C28 H29 Cl N2 O5 |
| Salt: | not_available |
| Smiles: | C1C(CN(CC(COCc2ccccc2)O)Cc2ccccc2[Cl])ON=C1c1ccc2c(c1)OCO2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2872 |
| logD: | 5.2812 |
| logSw: | -5.902 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.684 |
| InChI Key: | JGQCBNIUJTWGMB-UHFFFAOYSA-N |