ethyl 2-[3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamido]-5-phenyl-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
ethyl 2-[3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamido]-5-phenyl-1,3-thiazole-4-carboxylate
ethyl 2-[3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamido]-5-phenyl-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y042-5729 |
| Compound Name: | ethyl 2-[3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamido]-5-phenyl-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 449.49 |
| Molecular Formula: | C22 H19 N5 O4 S |
| Smiles: | CCOC(c1c(c2ccccc2)sc(NC(CCN2C(c3ccccc3N=N2)=O)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8322 |
| logD: | 3.8319 |
| logSw: | -3.9422 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.359 |
| InChI Key: | CHWOGIMSIFZRMA-UHFFFAOYSA-N |