1-{2-(4-chlorophenyl)-5-[2-(5-methylfuran-2-yl)anilino]-2H-1,2,3-triazol-4-yl}ethan-1-one
Chemical Structure Depiction of
1-{2-(4-chlorophenyl)-5-[2-(5-methylfuran-2-yl)anilino]-2H-1,2,3-triazol-4-yl}ethan-1-one
1-{2-(4-chlorophenyl)-5-[2-(5-methylfuran-2-yl)anilino]-2H-1,2,3-triazol-4-yl}ethan-1-one
Compound characteristics
| Compound ID: | D153-0067 |
| Compound Name: | 1-{2-(4-chlorophenyl)-5-[2-(5-methylfuran-2-yl)anilino]-2H-1,2,3-triazol-4-yl}ethan-1-one |
| Molecular Weight: | 392.84 |
| Molecular Formula: | C21 H17 Cl N4 O2 |
| Smiles: | CC(c1c(Nc2ccccc2c2ccc(C)o2)nn(c2ccc(cc2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8947 |
| logD: | 4.8947 |
| logSw: | -4.9329 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.843 |
| InChI Key: | GGPHAVXYRCFAPZ-UHFFFAOYSA-N |