1-({[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(3-methoxyphenyl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-({[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(3-methoxyphenyl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-({[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(3-methoxyphenyl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V003-3168 |
| Compound Name: | 1-({[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}[(3-methoxyphenyl)methyl]amino)-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 442.94 |
| Molecular Formula: | C24 H27 Cl N2 O4 |
| Salt: | not_available |
| Smiles: | COc1cccc(CN(CC(COCC#C)O)CC2CC(c3ccc(cc3)[Cl])=NO2)c1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0601 |
| logD: | 3.8756 |
| logSw: | -4.4824 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.302 |
| InChI Key: | OFQZXAZXDWSKJE-UHFFFAOYSA-N |