{3-[2-(4-tert-butylphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}acetic acid
Chemical Structure Depiction of
{3-[2-(4-tert-butylphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}acetic acid
{3-[2-(4-tert-butylphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}acetic acid
Compound characteristics
| Compound ID: | 5629-1315 |
| Compound Name: | {3-[2-(4-tert-butylphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}acetic acid |
| Molecular Weight: | 460.51 |
| Molecular Formula: | C24 H20 N4 O4 S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nc2n(C(/C(=C3C(N(CC(O)=O)c4ccccc\34)=O)S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.5832 |
| logD: | -0.4422 |
| logSw: | -3.6823 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.32 |
| InChI Key: | FXCNTIJBXWBTNI-UHFFFAOYSA-N |