N-(4-bromo-2-fluorophenyl)-3-methyl-2-nitrobenzamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-3-methyl-2-nitrobenzamide
N-(4-bromo-2-fluorophenyl)-3-methyl-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-3223 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-3-methyl-2-nitrobenzamide |
| Molecular Weight: | 353.14 |
| Molecular Formula: | C14 H10 Br F N2 O3 |
| Smiles: | Cc1cccc(C(Nc2ccc(cc2F)[Br])=O)c1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2354 |
| logD: | 1.3753 |
| logSw: | -4.5564 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.411 |
| InChI Key: | XNXIQRKMSACSES-UHFFFAOYSA-N |