[5-({[4-(benzyloxy)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](2-nitrophenyl)methanone
Chemical Structure Depiction of
[5-({[4-(benzyloxy)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](2-nitrophenyl)methanone
[5-({[4-(benzyloxy)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](2-nitrophenyl)methanone
Compound characteristics
| Compound ID: | D331-0597 |
| Compound Name: | [5-({[4-(benzyloxy)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](2-nitrophenyl)methanone |
| Molecular Weight: | 495.49 |
| Molecular Formula: | C27 H21 N5 O5 |
| Smiles: | C(c1ccc(cc1)OCc1ccccc1)Nc1nc(c2ccco2)nn1C(c1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2949 |
| logD: | 4.2949 |
| logSw: | -4.6552 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.114 |
| InChI Key: | OQPDQGBMIXTKGC-UHFFFAOYSA-N |