N-[7-(4-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-4-chlorobenzamide
Chemical Structure Depiction of
N-[7-(4-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-4-chlorobenzamide
N-[7-(4-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-4-chlorobenzamide
Compound characteristics
| Compound ID: | 3448-6689 |
| Compound Name: | N-[7-(4-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-4-chlorobenzamide |
| Molecular Weight: | 472.72 |
| Molecular Formula: | C22 H15 Br Cl N O4 |
| Smiles: | C1COc2cc(c(cc2O1)C(c1ccc(cc1)[Br])=O)NC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5323 |
| logD: | 4.2095 |
| logSw: | -4.6925 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.922 |
| InChI Key: | QYQYZVBMABTKAC-UHFFFAOYSA-N |