3-({[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(3-chlorophenyl)methyl]amino)-2-hydroxypropyl butanoate
Chemical Structure Depiction of
3-({[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(3-chlorophenyl)methyl]amino)-2-hydroxypropyl butanoate
3-({[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(3-chlorophenyl)methyl]amino)-2-hydroxypropyl butanoate
Compound characteristics
| Compound ID: | V012-1606 |
| Compound Name: | 3-({[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(3-chlorophenyl)methyl]amino)-2-hydroxypropyl butanoate |
| Molecular Weight: | 479.4 |
| Molecular Formula: | C24 H28 Cl2 N2 O4 |
| Salt: | not_available |
| Smiles: | CCCC(=O)OCC(CN(CC1CC(c2ccc(cc2)[Cl])=NO1)Cc1cccc(c1)[Cl])O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5192 |
| logD: | 5.4792 |
| logSw: | -5.7273 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.94 |
| InChI Key: | BIGGIJGOPQQQFP-UHFFFAOYSA-N |