1-[5-(3,4-dimethoxyphenyl)-4-(4-methylphenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
Chemical Structure Depiction of
1-[5-(3,4-dimethoxyphenyl)-4-(4-methylphenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
1-[5-(3,4-dimethoxyphenyl)-4-(4-methylphenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
Compound characteristics
| Compound ID: | 5868-0013 |
| Compound Name: | 1-[5-(3,4-dimethoxyphenyl)-4-(4-methylphenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C25 H25 N3 O3 |
| Smiles: | CC(C1=NN(C(c2ccc(c(c2)OC)OC)N1c1ccc(C)cc1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0141 |
| logD: | 5.0141 |
| logSw: | -4.7537 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.944 |
| InChI Key: | CQZXFOWTWARRBW-RUZDIDTESA-N |