N-(2-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(4-methylphenyl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(4-methylphenyl)sulfanyl]acetamide
N-(2-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(4-methylphenyl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D336-2238 |
| Compound Name: | N-(2-{[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(4-methylphenyl)sulfanyl]acetamide |
| Molecular Weight: | 497.63 |
| Molecular Formula: | C24 H20 F N3 O2 S3 |
| Smiles: | Cc1ccc(cc1)SCC(Nc1ccc2c(c1)sc(n2)SCC(Nc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0783 |
| logD: | 6.0782 |
| logSw: | -5.4078 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.076 |
| InChI Key: | DGRGWTMLJULSDS-UHFFFAOYSA-N |