N-(4-bromo-2-fluorophenyl)-4-(4-methoxyphenyl)-2,4-dioxobutanamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-4-(4-methoxyphenyl)-2,4-dioxobutanamide
N-(4-bromo-2-fluorophenyl)-4-(4-methoxyphenyl)-2,4-dioxobutanamide
Compound characteristics
| Compound ID: | C301-0045 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-4-(4-methoxyphenyl)-2,4-dioxobutanamide |
| Molecular Weight: | 394.19 |
| Molecular Formula: | C17 H13 Br F N O4 |
| Smiles: | COc1ccc(cc1)C(CC(C(Nc1ccc(cc1F)[Br])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0694 |
| logD: | 2.5556 |
| logSw: | -3.5996 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.669 |
| InChI Key: | COLGZXZYFWPTSL-UHFFFAOYSA-N |