[3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]amino}-1H-1,2,4-triazol-1-yl](2-methylphenyl)methanone
Chemical Structure Depiction of
[3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]amino}-1H-1,2,4-triazol-1-yl](2-methylphenyl)methanone
[3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]amino}-1H-1,2,4-triazol-1-yl](2-methylphenyl)methanone
Compound characteristics
| Compound ID: | D116-0107 |
| Compound Name: | [3-(furan-2-yl)-5-{[(4-methoxyphenyl)methyl]amino}-1H-1,2,4-triazol-1-yl](2-methylphenyl)methanone |
| Molecular Weight: | 388.42 |
| Molecular Formula: | C22 H20 N4 O3 |
| Smiles: | Cc1ccccc1C(n1c(NCc2ccc(cc2)OC)nc(c2ccco2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6687 |
| logD: | 3.6687 |
| logSw: | -3.9834 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.349 |
| InChI Key: | JMYYRUACZBKPDR-UHFFFAOYSA-N |