1-{5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}-N-[3-(furan-2-yl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine
Chemical Structure Depiction of
1-{5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}-N-[3-(furan-2-yl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine
1-{5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}-N-[3-(furan-2-yl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine
Compound characteristics
| Compound ID: | Y508-9046 |
| Compound Name: | 1-{5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}-N-[3-(furan-2-yl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine |
| Molecular Weight: | 428.9 |
| Molecular Formula: | C20 H17 Cl N4 O3 S |
| Smiles: | Cc1cccc(c1OCc1ccc(/C=N/n2c(c3ccco3)nnc2SC)o1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8564 |
| logD: | 4.8561 |
| logSw: | -4.864 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.596 |
| InChI Key: | XOTQPZVNMUSSJI-UHFFFAOYSA-N |