5-(3-bromophenyl)-7-(3,4,5-trimethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
5-(3-bromophenyl)-7-(3,4,5-trimethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
5-(3-bromophenyl)-7-(3,4,5-trimethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-1438 |
| Compound Name: | 5-(3-bromophenyl)-7-(3,4,5-trimethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 443.3 |
| Molecular Formula: | C20 H19 Br N4 O3 |
| Smiles: | COc1cc(cc(c1OC)OC)C1C=C(c2cccc(c2)[Br])Nc2ncnn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2198 |
| logD: | 4.2115 |
| logSw: | -4.4838 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.578 |
| InChI Key: | MRCTTWCIKAQTSL-MRXNPFEDSA-N |