2-benzyl-7-(3-bromophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-benzyl-7-(3-bromophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
2-benzyl-7-(3-bromophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
Compound ID: | D049-0214 |
Compound Name: | 2-benzyl-7-(3-bromophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
Molecular Weight: | 405.25 |
Molecular Formula: | C19 H13 Br N6 |
Smiles: | C(c1ccccc1)c1nc2c3cnn(c4cccc(c4)[Br])c3ncn2n1 |
Stereo: | ACHIRAL |
logP: | 4.3243 |
logD: | 4.3197 |
logSw: | -4.4939 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 45.432 |
InChI Key: | KSIIMKXDWYHCHR-UHFFFAOYSA-N |