N~5~-(3-bromophenyl)-N~6~-(4-methoxyphenyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Chemical Structure Depiction of
N~5~-(3-bromophenyl)-N~6~-(4-methoxyphenyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
N~5~-(3-bromophenyl)-N~6~-(4-methoxyphenyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Compound characteristics
| Compound ID: | D268-0136 |
| Compound Name: | N~5~-(3-bromophenyl)-N~6~-(4-methoxyphenyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine |
| Molecular Weight: | 413.23 |
| Molecular Formula: | C17 H13 Br N6 O2 |
| Smiles: | COc1ccc(cc1)Nc1c(Nc2cccc(c2)[Br])nc2c(n1)non2 |
| Stereo: | ACHIRAL |
| logP: | 5.2479 |
| logD: | 5.2479 |
| logSw: | -5.227 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.09 |
| InChI Key: | WEJPXJSVSOMUCJ-UHFFFAOYSA-N |