N-[2-(4-chlorophenoxy)ethyl]-2-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[2-(4-chlorophenoxy)ethyl]-2-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
N-[2-(4-chlorophenoxy)ethyl]-2-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8009-0409 |
| Compound Name: | N-[2-(4-chlorophenoxy)ethyl]-2-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 524.02 |
| Molecular Formula: | C25 H18 Cl N3 O4 S2 |
| Smiles: | C(COc1ccc(cc1)[Cl])NC(CSc1nc2ccc(cc2s1)N1C(c2ccccc2C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2517 |
| logD: | 5.2517 |
| logSw: | -5.7955 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.421 |
| InChI Key: | JLJTZLKOEIMFFI-UHFFFAOYSA-N |