[5-({[4-(benzyloxy)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](phenyl)methanone
Chemical Structure Depiction of
[5-({[4-(benzyloxy)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](phenyl)methanone
[5-({[4-(benzyloxy)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](phenyl)methanone
Compound characteristics
Compound ID: | D331-0584 |
Compound Name: | [5-({[4-(benzyloxy)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](phenyl)methanone |
Molecular Weight: | 450.5 |
Molecular Formula: | C27 H22 N4 O3 |
Smiles: | C(c1ccc(cc1)OCc1ccccc1)Nc1nc(c2ccco2)nn1C(c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 4.7456 |
logD: | 4.7456 |
logSw: | -4.9518 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.033 |
InChI Key: | PMHKANVELDCKNL-UHFFFAOYSA-N |