2-[({2-[(2-chloro-4-fluorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-1,3-benzothiazole
Chemical Structure Depiction of
2-[({2-[(2-chloro-4-fluorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-1,3-benzothiazole
2-[({2-[(2-chloro-4-fluorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-1,3-benzothiazole
Compound characteristics
| Compound ID: | V008-6301 |
| Compound Name: | 2-[({2-[(2-chloro-4-fluorophenyl)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-1,3-benzothiazole |
| Molecular Weight: | 406.95 |
| Molecular Formula: | C18 H12 Cl F N2 S3 |
| Smiles: | C(c1ccc(cc1[Cl])F)c1nc(CSc2nc3ccccc3s2)cs1 |
| Stereo: | ACHIRAL |
| logP: | 6.9896 |
| logD: | 6.9896 |
| logSw: | -6.8788 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 19.7728 |
| InChI Key: | BPEMUJLDLYEGIA-UHFFFAOYSA-N |