cyclohexyl[3-(furan-2-yl)-5-{[(5-methylfuran-2-yl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone
Chemical Structure Depiction of
cyclohexyl[3-(furan-2-yl)-5-{[(5-methylfuran-2-yl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone
cyclohexyl[3-(furan-2-yl)-5-{[(5-methylfuran-2-yl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone
Compound characteristics
| Compound ID: | D331-0098 |
| Compound Name: | cyclohexyl[3-(furan-2-yl)-5-{[(5-methylfuran-2-yl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone |
| Molecular Weight: | 354.41 |
| Molecular Formula: | C19 H22 N4 O3 |
| Smiles: | Cc1ccc(CNc2nc(c3ccco3)nn2C(C2CCCCC2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.8509 |
| logD: | 3.8509 |
| logSw: | -3.9087 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.26 |
| InChI Key: | VGQCMQBJXRPAKJ-UHFFFAOYSA-N |