2-[7-(2-bromophenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
Chemical Structure Depiction of
2-[7-(2-bromophenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
2-[7-(2-bromophenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol
Compound characteristics
| Compound ID: | D472-0690 |
| Compound Name: | 2-[7-(2-bromophenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]phenol |
| Molecular Weight: | 434.29 |
| Molecular Formula: | C21 H16 Br N5 O |
| Smiles: | Cc1c2c(ncn3c2nc(c2ccccc2O)n3)n(c2ccccc2[Br])c1C |
| Stereo: | ACHIRAL |
| logP: | 4.9694 |
| logD: | 4.8305 |
| logSw: | -4.3258 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.064 |
| InChI Key: | VWQJFYDBPAQMJJ-UHFFFAOYSA-N |