N-(4-{[4-(1,3-benzoxazol-2-yl)phenyl]carbamoyl}phenyl)-3-iodobenzamide
Chemical Structure Depiction of
N-(4-{[4-(1,3-benzoxazol-2-yl)phenyl]carbamoyl}phenyl)-3-iodobenzamide
N-(4-{[4-(1,3-benzoxazol-2-yl)phenyl]carbamoyl}phenyl)-3-iodobenzamide
Compound characteristics
| Compound ID: | 2080-0452 |
| Compound Name: | N-(4-{[4-(1,3-benzoxazol-2-yl)phenyl]carbamoyl}phenyl)-3-iodobenzamide |
| Molecular Weight: | 559.36 |
| Molecular Formula: | C27 H18 I N3 O3 |
| Smiles: | c1ccc2c(c1)nc(c1ccc(cc1)NC(c1ccc(cc1)NC(c1cccc(c1)I)=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 6.5038 |
| logD: | 6.4279 |
| logSw: | -6.3036 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.231 |
| InChI Key: | IBCQVSNRDBJDNL-UHFFFAOYSA-N |