5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 5629-0119 |
| Compound Name: | 5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 416.41 |
| Molecular Formula: | C21 H12 N4 O4 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3ccccc3)n2)S1)=O)\c1ccc(c2cccc(c2)[N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.1501 |
| logD: | 5.1501 |
| logSw: | -5.4678 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.147 |
| InChI Key: | DXFYDIBITRIWBX-UHFFFAOYSA-N |