4-[({5-[(2-methylphenoxy)methyl]furan-2-yl}methylidene)amino]-5-(thiophen-2-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-[({5-[(2-methylphenoxy)methyl]furan-2-yl}methylidene)amino]-5-(thiophen-2-yl)-4H-1,2,4-triazole-3-thiol
4-[({5-[(2-methylphenoxy)methyl]furan-2-yl}methylidene)amino]-5-(thiophen-2-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y508-8856 |
| Compound Name: | 4-[({5-[(2-methylphenoxy)methyl]furan-2-yl}methylidene)amino]-5-(thiophen-2-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 396.49 |
| Molecular Formula: | C19 H16 N4 O2 S2 |
| Smiles: | Cc1ccccc1OCc1ccc(/C=N/n2c(c3cccs3)nnc2S)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.4951 |
| logD: | 4.2004 |
| logSw: | -4.4917 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.423 |
| InChI Key: | CMUUTUNXNCLNBU-UHFFFAOYSA-N |