N-[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]-2,5-diiodobenzamide
Chemical Structure Depiction of
N-[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]-2,5-diiodobenzamide
N-[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]-2,5-diiodobenzamide
Compound characteristics
| Compound ID: | 2154-0293 |
| Compound Name: | N-[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]-2,5-diiodobenzamide |
| Molecular Weight: | 645.03 |
| Molecular Formula: | C20 H11 Br I2 N2 O2 |
| Smiles: | c1cc(cc(c1)[Br])c1nc2cc(ccc2o1)NC(c1cc(ccc1I)I)=O |
| Stereo: | ACHIRAL |
| logP: | 7.6389 |
| logD: | 7.5624 |
| logSw: | -6.2209 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.14 |
| InChI Key: | ITHJKZJMKKENER-UHFFFAOYSA-N |