1-{2-(4-chlorophenyl)-5-[(quinolin-3-yl)amino]-2H-1,2,3-triazol-4-yl}ethan-1-one
Chemical Structure Depiction of
1-{2-(4-chlorophenyl)-5-[(quinolin-3-yl)amino]-2H-1,2,3-triazol-4-yl}ethan-1-one
1-{2-(4-chlorophenyl)-5-[(quinolin-3-yl)amino]-2H-1,2,3-triazol-4-yl}ethan-1-one
Compound characteristics
| Compound ID: | D153-0066 |
| Compound Name: | 1-{2-(4-chlorophenyl)-5-[(quinolin-3-yl)amino]-2H-1,2,3-triazol-4-yl}ethan-1-one |
| Molecular Weight: | 363.8 |
| Molecular Formula: | C19 H14 Cl N5 O |
| Smiles: | CC(c1c(Nc2cc3ccccc3nc2)nn(c2ccc(cc2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8766 |
| logD: | 3.8766 |
| logSw: | -4.0508 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.573 |
| InChI Key: | QFQJSYDIBGCMLI-UHFFFAOYSA-N |