5-(furan-2-yl)-4-[({5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}methylidene)amino]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(furan-2-yl)-4-[({5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}methylidene)amino]-4H-1,2,4-triazole-3-thiol
5-(furan-2-yl)-4-[({5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}methylidene)amino]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y508-8675 |
| Compound Name: | 5-(furan-2-yl)-4-[({5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}methylidene)amino]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 385.36 |
| Molecular Formula: | C15 H11 N7 O4 S |
| Smiles: | C(c1ccc(/C=N/n2c(c3ccco3)nnc2S)o1)n1cc(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.4945 |
| logD: | 1.199 |
| logSw: | -1.8427 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.556 |
| InChI Key: | SRBWPJAWWBNJDD-UHFFFAOYSA-N |