2-(2-bromophenyl)-8,9-dimethyl-7-(3-methylpyridin-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-(2-bromophenyl)-8,9-dimethyl-7-(3-methylpyridin-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-(2-bromophenyl)-8,9-dimethyl-7-(3-methylpyridin-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
Compound ID: | D472-0512 |
Compound Name: | 2-(2-bromophenyl)-8,9-dimethyl-7-(3-methylpyridin-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
Molecular Weight: | 433.31 |
Molecular Formula: | C21 H17 Br N6 |
Smiles: | Cc1cccnc1n1c(C)c(C)c2c1ncn1c2nc(c2ccccc2[Br])n1 |
Stereo: | ACHIRAL |
logP: | 4.2661 |
logD: | 2.8055 |
logSw: | -4.6242 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 41.798 |
InChI Key: | KPMZUBKKPUYSAW-UHFFFAOYSA-N |