5-(4-bromophenyl)-7-(2,3,4-trimethoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
5-(4-bromophenyl)-7-(2,3,4-trimethoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine
5-(4-bromophenyl)-7-(2,3,4-trimethoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine
Compound characteristics
Compound ID: | K832-1196 |
Compound Name: | 5-(4-bromophenyl)-7-(2,3,4-trimethoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine |
Molecular Weight: | 444.29 |
Molecular Formula: | C19 H18 Br N5 O3 |
Smiles: | COc1ccc(C2C=C(c3ccc(cc3)[Br])Nc3nnnn23)c(c1OC)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 4.0688 |
logD: | 3.9962 |
logSw: | -4.2759 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.141 |
InChI Key: | PBOCLYDLTGYJMB-OAHLLOKOSA-N |