1-[5-({[4-(benzyloxy)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-3-methylbutan-1-one
Chemical Structure Depiction of
1-[5-({[4-(benzyloxy)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-3-methylbutan-1-one
1-[5-({[4-(benzyloxy)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-3-methylbutan-1-one
Compound characteristics
| Compound ID: | D331-0606 |
| Compound Name: | 1-[5-({[4-(benzyloxy)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-3-methylbutan-1-one |
| Molecular Weight: | 430.51 |
| Molecular Formula: | C25 H26 N4 O3 |
| Smiles: | CC(C)CC(n1c(NCc2ccc(cc2)OCc2ccccc2)nc(c2ccco2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6671 |
| logD: | 4.6671 |
| logSw: | -4.5297 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.777 |
| InChI Key: | QKFPWNGLWOSEAZ-UHFFFAOYSA-N |