2-(3-chlorophenyl)-5-[(4-nitrophenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-5-[(4-nitrophenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
2-(3-chlorophenyl)-5-[(4-nitrophenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 6187-1745 |
| Compound Name: | 2-(3-chlorophenyl)-5-[(4-nitrophenyl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 384.8 |
| Molecular Formula: | C17 H9 Cl N4 O3 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3cccc(c3)[Cl])n2)S1)=O)\c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6779 |
| logD: | 4.6779 |
| logSw: | -5.2549 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.577 |
| InChI Key: | LKHWSIMDBOYVJR-UHFFFAOYSA-N |