N-[2-(3-bromo-4-methylphenyl)-1,3-benzoxazol-5-yl]-2,5-diiodobenzamide
Chemical Structure Depiction of
N-[2-(3-bromo-4-methylphenyl)-1,3-benzoxazol-5-yl]-2,5-diiodobenzamide
N-[2-(3-bromo-4-methylphenyl)-1,3-benzoxazol-5-yl]-2,5-diiodobenzamide
Compound characteristics
| Compound ID: | 2154-0308 |
| Compound Name: | N-[2-(3-bromo-4-methylphenyl)-1,3-benzoxazol-5-yl]-2,5-diiodobenzamide |
| Molecular Weight: | 659.06 |
| Molecular Formula: | C21 H13 Br I2 N2 O2 |
| Smiles: | Cc1ccc(cc1[Br])c1nc2cc(ccc2o1)NC(c1cc(ccc1I)I)=O |
| Stereo: | ACHIRAL |
| logP: | 8.0029 |
| logD: | 7.9264 |
| logSw: | -5.734 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.14 |
| InChI Key: | LKSKZFWBDVAQDQ-UHFFFAOYSA-N |