ethyl 5-{[2-(4-bromophenyl)-8-nitro-10H-imidazo[1',2':2,3][1,2,4]triazino[5,6-b]indol-10-yl]methyl}furan-2-carboxylate
Chemical Structure Depiction of
ethyl 5-{[2-(4-bromophenyl)-8-nitro-10H-imidazo[1',2':2,3][1,2,4]triazino[5,6-b]indol-10-yl]methyl}furan-2-carboxylate
ethyl 5-{[2-(4-bromophenyl)-8-nitro-10H-imidazo[1',2':2,3][1,2,4]triazino[5,6-b]indol-10-yl]methyl}furan-2-carboxylate
Compound characteristics
Compound ID: | K216-0471 |
Compound Name: | ethyl 5-{[2-(4-bromophenyl)-8-nitro-10H-imidazo[1',2':2,3][1,2,4]triazino[5,6-b]indol-10-yl]methyl}furan-2-carboxylate |
Molecular Weight: | 561.35 |
Molecular Formula: | C25 H17 Br N6 O5 |
Smiles: | CCOC(c1ccc(Cn2c3cc(ccc3c3c2nc2nc(cn2n3)c2ccc(cc2)[Br])[N+]([O-])=O)o1)=O |
Stereo: | ACHIRAL |
logP: | 6.0993 |
logD: | 6.0993 |
logSw: | -5.5199 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 94.002 |
InChI Key: | DUOFTOFZDPJLOH-UHFFFAOYSA-N |