N-(2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(4-methylphenoxy)acetamide
Chemical Structure Depiction of
N-(2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(4-methylphenoxy)acetamide
N-(2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(4-methylphenoxy)acetamide
Compound characteristics
| Compound ID: | D336-2301 |
| Compound Name: | N-(2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(4-methylphenoxy)acetamide |
| Molecular Weight: | 498.02 |
| Molecular Formula: | C24 H20 Cl N3 O3 S2 |
| Smiles: | Cc1ccc(cc1)OCC(Nc1ccc2c(c1)sc(n2)SCC(Nc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.648 |
| logD: | 5.6479 |
| logSw: | -5.8717 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.877 |
| InChI Key: | DTUDBGBRCPIZLO-UHFFFAOYSA-N |