[5-{[(furan-2-yl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3-methylphenyl)methanone
Chemical Structure Depiction of
[5-{[(furan-2-yl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3-methylphenyl)methanone
[5-{[(furan-2-yl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3-methylphenyl)methanone
Compound characteristics
| Compound ID: | D116-0250 |
| Compound Name: | [5-{[(furan-2-yl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](3-methylphenyl)methanone |
| Molecular Weight: | 359.39 |
| Molecular Formula: | C20 H17 N5 O2 |
| Smiles: | Cc1cccc(c1)C(n1c(NCc2ccco2)nc(c2cccnc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.044 |
| logD: | 2.8946 |
| logSw: | -2.8921 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.494 |
| InChI Key: | VLSMHHFJGLQGRK-UHFFFAOYSA-N |