2-(2,4-dimethylphenyl)-2-oxoethyl [(1,3-benzothiazol-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
2-(2,4-dimethylphenyl)-2-oxoethyl [(1,3-benzothiazol-2-yl)sulfanyl]acetate
2-(2,4-dimethylphenyl)-2-oxoethyl [(1,3-benzothiazol-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 8011-9056 |
| Compound Name: | 2-(2,4-dimethylphenyl)-2-oxoethyl [(1,3-benzothiazol-2-yl)sulfanyl]acetate |
| Molecular Weight: | 371.48 |
| Molecular Formula: | C19 H17 N O3 S2 |
| Smiles: | Cc1ccc(C(COC(CSc2nc3ccccc3s2)=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.3038 |
| logD: | 5.3038 |
| logSw: | -5.2541 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.829 |
| InChI Key: | VVHDVTPFGBLWEC-UHFFFAOYSA-N |