N-[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Chemical Structure Depiction of
N-[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
N-[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Compound characteristics
| Compound ID: | 2810-2615 |
| Compound Name: | N-[2-(4-iodophenyl)-1,3-benzoxazol-5-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide |
| Molecular Weight: | 498.28 |
| Molecular Formula: | C22 H15 I N2 O4 |
| Smiles: | C1COc2cc(ccc2O1)C(Nc1ccc2c(c1)nc(c1ccc(cc1)I)o2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.819 |
| logD: | 4.8188 |
| logSw: | -4.9539 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.963 |
| InChI Key: | PZMHUZGJJFPTEB-UHFFFAOYSA-N |