N~5~-(4-bromophenyl)-N~6~-(2,3-dimethylphenyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Chemical Structure Depiction of
N~5~-(4-bromophenyl)-N~6~-(2,3-dimethylphenyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
N~5~-(4-bromophenyl)-N~6~-(2,3-dimethylphenyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Compound characteristics
| Compound ID: | D268-0111 |
| Compound Name: | N~5~-(4-bromophenyl)-N~6~-(2,3-dimethylphenyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine |
| Molecular Weight: | 411.26 |
| Molecular Formula: | C18 H15 Br N6 O |
| Smiles: | Cc1cccc(c1C)Nc1c(Nc2ccc(cc2)[Br])nc2c(n1)non2 |
| Stereo: | ACHIRAL |
| logP: | 6.2387 |
| logD: | 6.2387 |
| logSw: | -5.851 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.848 |
| InChI Key: | JMSJOKYHEKAQEV-UHFFFAOYSA-N |