N-(2-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(3-methylphenoxy)acetamide
Chemical Structure Depiction of
N-(2-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(3-methylphenoxy)acetamide
N-(2-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(3-methylphenoxy)acetamide
Compound characteristics
| Compound ID: | D336-2229 |
| Compound Name: | N-(2-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(3-methylphenoxy)acetamide |
| Molecular Weight: | 481.57 |
| Molecular Formula: | C24 H20 F N3 O3 S2 |
| Smiles: | Cc1cccc(c1)OCC(Nc1ccc2c(c1)sc(n2)SCC(Nc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6942 |
| logD: | 5.6941 |
| logSw: | -5.4 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.575 |
| InChI Key: | LDBGIFBHJOXQDX-UHFFFAOYSA-N |