1-[(4-methylphenyl)methyl]-3-[6-oxo-2-(2-phenylethenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
1-[(4-methylphenyl)methyl]-3-[6-oxo-2-(2-phenylethenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1,3-dihydro-2H-indol-2-one
1-[(4-methylphenyl)methyl]-3-[6-oxo-2-(2-phenylethenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1,3-dihydro-2H-indol-2-one
Compound characteristics
| Compound ID: | Y070-3129 |
| Compound Name: | 1-[(4-methylphenyl)methyl]-3-[6-oxo-2-(2-phenylethenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1,3-dihydro-2H-indol-2-one |
| Molecular Weight: | 476.56 |
| Molecular Formula: | C28 H20 N4 O2 S |
| Smiles: | Cc1ccc(CN2C(C(=C3/C(n4c(nc(/C=C/c5ccccc5)n4)S3)=O)/c3ccccc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4952 |
| logD: | 5.4952 |
| logSw: | -5.4538 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.655 |
| InChI Key: | PPQAUYCTSOLXFI-UHFFFAOYSA-N |