1-[5-amino-3-(2-methylphenyl)-1H-1,2,4-triazol-1-yl]-2-phenylbutan-1-one
Chemical Structure Depiction of
1-[5-amino-3-(2-methylphenyl)-1H-1,2,4-triazol-1-yl]-2-phenylbutan-1-one
1-[5-amino-3-(2-methylphenyl)-1H-1,2,4-triazol-1-yl]-2-phenylbutan-1-one
Compound characteristics
| Compound ID: | D481-1869 |
| Compound Name: | 1-[5-amino-3-(2-methylphenyl)-1H-1,2,4-triazol-1-yl]-2-phenylbutan-1-one |
| Molecular Weight: | 320.39 |
| Molecular Formula: | C19 H20 N4 O |
| Smiles: | CCC(C(n1c(N)nc(c2ccccc2C)n1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6015 |
| logD: | 3.6007 |
| logSw: | -3.776 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.847 |
| InChI Key: | KJVHRUMGAKWTJW-OAHLLOKOSA-N |