N-[1-(2H-1,3-benzodioxol-5-yl)-3-(3-fluoro-4-methylanilino)-3-oxoprop-1-en-2-yl]-4-bromobenzamide
Chemical Structure Depiction of
N-[1-(2H-1,3-benzodioxol-5-yl)-3-(3-fluoro-4-methylanilino)-3-oxoprop-1-en-2-yl]-4-bromobenzamide
N-[1-(2H-1,3-benzodioxol-5-yl)-3-(3-fluoro-4-methylanilino)-3-oxoprop-1-en-2-yl]-4-bromobenzamide
Compound characteristics
| Compound ID: | 2681-3363 |
| Compound Name: | N-[1-(2H-1,3-benzodioxol-5-yl)-3-(3-fluoro-4-methylanilino)-3-oxoprop-1-en-2-yl]-4-bromobenzamide |
| Molecular Weight: | 497.32 |
| Molecular Formula: | C24 H18 Br F N2 O4 |
| Smiles: | Cc1ccc(cc1F)NC(/C(=C/c1ccc2c(c1)OCO2)NC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6557 |
| logD: | 5.2975 |
| logSw: | -5.5302 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.37 |
| InChI Key: | HQLFOMNWNXDOIY-UHFFFAOYSA-N |