7-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-5-(4-iodophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-5-(4-iodophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
7-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-5-(4-iodophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | Y509-2713 |
| Compound Name: | 7-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-5-(4-iodophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 432.26 |
| Molecular Formula: | C17 H17 I N6 |
| Smiles: | CCn1cc(C2C=C(c3ccc(cc3)I)Nc3ncnn23)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6337 |
| logD: | 3.6326 |
| logSw: | -3.5724 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.455 |
| InChI Key: | NNOMJVAHYHDMRH-MRXNPFEDSA-N |