(3-bromophenyl)methyl 1,2-dimethyl-4-nitro-1H-imidazole-5-carboxylate
Chemical Structure Depiction of
(3-bromophenyl)methyl 1,2-dimethyl-4-nitro-1H-imidazole-5-carboxylate
(3-bromophenyl)methyl 1,2-dimethyl-4-nitro-1H-imidazole-5-carboxylate
Compound characteristics
| Compound ID: | 8016-0636 |
| Compound Name: | (3-bromophenyl)methyl 1,2-dimethyl-4-nitro-1H-imidazole-5-carboxylate |
| Molecular Weight: | 354.16 |
| Molecular Formula: | C13 H12 Br N3 O4 |
| Smiles: | Cc1nc(c(C(=O)OCc2cccc(c2)[Br])n1C)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.2152 |
| logD: | 2.2152 |
| logSw: | -2.6201 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.738 |
| InChI Key: | GJGUGVUMWHKTJE-UHFFFAOYSA-N |