N-[(5-methylfuran-2-yl)methyl]-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-[(5-methylfuran-2-yl)methyl]-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
N-[(5-methylfuran-2-yl)methyl]-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | M031-0176 |
| Compound Name: | N-[(5-methylfuran-2-yl)methyl]-4-[(1H-1,2,4-triazol-1-yl)methyl]benzamide |
| Molecular Weight: | 296.33 |
| Molecular Formula: | C16 H16 N4 O2 |
| Smiles: | Cc1ccc(CNC(c2ccc(Cn3cncn3)cc2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 1.5891 |
| logD: | 1.5891 |
| logSw: | -2.0287 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.891 |
| InChI Key: | WMNXGLVMOMZAKU-UHFFFAOYSA-N |