N-[7-(3-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2-fluorobenzamide
Chemical Structure Depiction of
N-[7-(3-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2-fluorobenzamide
N-[7-(3-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2-fluorobenzamide
Compound characteristics
| Compound ID: | 8017-1571 |
| Compound Name: | N-[7-(3-bromobenzoyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2-fluorobenzamide |
| Molecular Weight: | 456.27 |
| Molecular Formula: | C22 H15 Br F N O4 |
| Smiles: | C1COc2cc(c(cc2O1)C(c1cccc(c1)[Br])=O)NC(c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.988 |
| logD: | 3.6652 |
| logSw: | -4.3111 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.922 |
| InChI Key: | NEJFVRVNEXZHGG-UHFFFAOYSA-N |