2-[(5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)sulfanyl]-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]acetohydrazide
Chemical Structure Depiction of
2-[(5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)sulfanyl]-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]acetohydrazide
2-[(5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)sulfanyl]-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]acetohydrazide
Compound characteristics
| Compound ID: | IB01-7241 |
| Compound Name: | 2-[(5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)sulfanyl]-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]acetohydrazide |
| Molecular Weight: | 525.07 |
| Molecular Formula: | C21 H21 Cl N4 O4 S3 |
| Smiles: | COc1cc(c(cc1/C=N/NC(CSc1nnc(SCc2ccccc2[Cl])s1)=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.75 |
| logD: | 4.75 |
| logSw: | -5.45 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 210.01 |
| InChI Key: | JQLSPWDIHYZHDI-UHFFFAOYSA-N |