7-(2-bromophenyl)-2-(4-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
7-(2-bromophenyl)-2-(4-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
7-(2-bromophenyl)-2-(4-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | D472-0686 |
| Compound Name: | 7-(2-bromophenyl)-2-(4-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 448.32 |
| Molecular Formula: | C22 H18 Br N5 O |
| Smiles: | Cc1c2c(ncn3c2nc(c2ccc(cc2)OC)n3)n(c2ccccc2[Br])c1C |
| Stereo: | ACHIRAL |
| logP: | 4.9348 |
| logD: | 4.8083 |
| logSw: | -4.9527 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.06 |
| InChI Key: | GMRUJTDJOJPUBX-UHFFFAOYSA-N |