2-(4-methyl-3-nitrophenyl)-2-oxoethyl 4-amino-3,5-dibromobenzoate
Chemical Structure Depiction of
2-(4-methyl-3-nitrophenyl)-2-oxoethyl 4-amino-3,5-dibromobenzoate
2-(4-methyl-3-nitrophenyl)-2-oxoethyl 4-amino-3,5-dibromobenzoate
Compound characteristics
| Compound ID: | 3257-1948 |
| Compound Name: | 2-(4-methyl-3-nitrophenyl)-2-oxoethyl 4-amino-3,5-dibromobenzoate |
| Molecular Weight: | 472.09 |
| Molecular Formula: | C16 H12 Br2 N2 O5 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(COC(c1cc(c(c(c1)[Br])N)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5902 |
| logD: | 4.5902 |
| logSw: | -4.7101 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.81 |
| InChI Key: | YAZVXFNLLMHIQY-UHFFFAOYSA-N |