4-(6-methyl-1,3-benzothiazol-2-yl)phenyl 3-iodobenzoate
Chemical Structure Depiction of
4-(6-methyl-1,3-benzothiazol-2-yl)phenyl 3-iodobenzoate
4-(6-methyl-1,3-benzothiazol-2-yl)phenyl 3-iodobenzoate
Compound characteristics
| Compound ID: | 8010-1541 |
| Compound Name: | 4-(6-methyl-1,3-benzothiazol-2-yl)phenyl 3-iodobenzoate |
| Molecular Weight: | 471.31 |
| Molecular Formula: | C21 H14 I N O2 S |
| Smiles: | Cc1ccc2c(c1)sc(c1ccc(cc1)OC(c1cccc(c1)I)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 6.6933 |
| logD: | 6.6933 |
| logSw: | -5.7687 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.0651 |
| InChI Key: | OHFFNVREDBKDHR-UHFFFAOYSA-N |