2-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Chemical Structure Depiction of
2-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
2-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Compound characteristics
| Compound ID: | 5629-1858 |
| Compound Name: | 2-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-6-methyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione |
| Molecular Weight: | 457.51 |
| Molecular Formula: | C24 H19 N5 O3 S |
| Smiles: | [H]C(=C1/C(N2C(=NC(C(C)=N2)=O)S1)=O)\c1cn(c2ccccc2)nc1c1ccc(cc1)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.6546 |
| logD: | 3.6546 |
| logSw: | -3.6588 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.849 |
| InChI Key: | ZEEDJTOABOHEQC-UHFFFAOYSA-N |