methyl 7-(4-bromophenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Chemical Structure Depiction of
methyl 7-(4-bromophenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
methyl 7-(4-bromophenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate
Compound characteristics
| Compound ID: | 8018-4206 |
| Compound Name: | methyl 7-(4-bromophenyl)-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate |
| Molecular Weight: | 366.17 |
| Molecular Formula: | C14 H12 Br N3 O4 |
| Smiles: | COC(C1CC2(CC(N(C2=O)c2ccc(cc2)[Br])=O)NN=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3829 |
| logD: | 0.6651 |
| logSw: | -2.0206 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.44 |
| InChI Key: | IUMDKMYNJXFLFE-AWEZNQCLSA-N |