N-[4-(5-tert-butyl-1,3-benzoxazol-2-yl)phenyl]-3-iodobenzamide
Chemical Structure Depiction of
N-[4-(5-tert-butyl-1,3-benzoxazol-2-yl)phenyl]-3-iodobenzamide
N-[4-(5-tert-butyl-1,3-benzoxazol-2-yl)phenyl]-3-iodobenzamide
Compound characteristics
| Compound ID: | 1140-0088 |
| Compound Name: | N-[4-(5-tert-butyl-1,3-benzoxazol-2-yl)phenyl]-3-iodobenzamide |
| Molecular Weight: | 496.35 |
| Molecular Formula: | C24 H21 I N2 O2 |
| Smiles: | CC(C)(C)c1ccc2c(c1)nc(c1ccc(cc1)NC(c1cccc(c1)I)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 7.0756 |
| logD: | 7.0754 |
| logSw: | -5.7602 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.14 |
| InChI Key: | AWEFDENSZQZRGG-UHFFFAOYSA-N |