2,6-dimethyl-4-[(6-oxo-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl]phenyl acetate
Chemical Structure Depiction of
2,6-dimethyl-4-[(6-oxo-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl]phenyl acetate
2,6-dimethyl-4-[(6-oxo-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl]phenyl acetate
Compound characteristics
| Compound ID: | 5629-0942 |
| Compound Name: | 2,6-dimethyl-4-[(6-oxo-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl]phenyl acetate |
| Molecular Weight: | 391.45 |
| Molecular Formula: | C21 H17 N3 O3 S |
| Smiles: | [H]C(=C1/C(n2c(nc(c3ccccc3)n2)S1)=O)\c1cc(C)c(c(C)c1)OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5669 |
| logD: | 4.5669 |
| logSw: | -4.6018 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.12 |
| InChI Key: | HLNJTEPHXGUGRW-UHFFFAOYSA-N |