4-[(2-{[(1,3-benzoxazol-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]-2-methoxyphenyl (2,4-dioxo-1,3-thiazolidin-5-yl)acetate
Chemical Structure Depiction of
4-[(2-{[(1,3-benzoxazol-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]-2-methoxyphenyl (2,4-dioxo-1,3-thiazolidin-5-yl)acetate
4-[(2-{[(1,3-benzoxazol-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]-2-methoxyphenyl (2,4-dioxo-1,3-thiazolidin-5-yl)acetate
Compound characteristics
| Compound ID: | 5685-0596 |
| Compound Name: | 4-[(2-{[(1,3-benzoxazol-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]-2-methoxyphenyl (2,4-dioxo-1,3-thiazolidin-5-yl)acetate |
| Molecular Weight: | 514.53 |
| Molecular Formula: | C22 H18 N4 O7 S2 |
| Smiles: | COc1cc(/C=N/NC(CSc2nc3ccccc3o2)=O)ccc1OC(CC1C(NC(=O)S1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8167 |
| logD: | 2.3104 |
| logSw: | -3.3994 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 117.445 |
| InChI Key: | XATCTORQKJNVFS-KRWDZBQOSA-N |