2-(2-methylphenyl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(2-methylphenyl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(2-methylphenyl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6187-1568 |
| Compound Name: | 2-(2-methylphenyl)-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 430.44 |
| Molecular Formula: | C22 H14 N4 O4 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3ccccc3C)n2)S1)=O)\c1ccc(c2ccccc2[N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.9778 |
| logD: | 4.9778 |
| logSw: | -4.7647 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.846 |
| InChI Key: | OIFBRKRTRXGTJG-UHFFFAOYSA-N |