1-(4-{5-amino-4-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-1H-1,2,3-triazol-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{5-amino-4-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-1H-1,2,3-triazol-1-yl}phenyl)ethan-1-one
1-(4-{5-amino-4-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-1H-1,2,3-triazol-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | F988-1139 |
| Compound Name: | 1-(4-{5-amino-4-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-1H-1,2,3-triazol-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 389.48 |
| Molecular Formula: | C21 H19 N5 O S |
| Smiles: | CC(c1ccc(cc1)n1c(c(c2nc(cs2)c2ccc(C)cc2C)nn1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2015 |
| logD: | 4.2015 |
| logSw: | -4.4206 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.622 |
| InChI Key: | CKQOZPICVLBJHS-UHFFFAOYSA-N |