4-(6-methyl-1,3-benzothiazol-2-yl)phenyl 5-bromofuran-2-carboxylate
Chemical Structure Depiction of
4-(6-methyl-1,3-benzothiazol-2-yl)phenyl 5-bromofuran-2-carboxylate
4-(6-methyl-1,3-benzothiazol-2-yl)phenyl 5-bromofuran-2-carboxylate
Compound characteristics
| Compound ID: | 2366-0506 |
| Compound Name: | 4-(6-methyl-1,3-benzothiazol-2-yl)phenyl 5-bromofuran-2-carboxylate |
| Molecular Weight: | 414.28 |
| Molecular Formula: | C19 H12 Br N O3 S |
| Smiles: | Cc1ccc2c(c1)sc(c1ccc(cc1)OC(c1ccc(o1)[Br])=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.7047 |
| logD: | 5.7047 |
| logSw: | -5.4785 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.991 |
| InChI Key: | FPVAKVDMWYTRRN-UHFFFAOYSA-N |