1-{5-[3-chloro-2-(morpholin-4-yl)anilino]-2-[4-(trifluoromethoxy)phenyl]-2H-1,2,3-triazol-4-yl}ethan-1-one
Chemical Structure Depiction of
1-{5-[3-chloro-2-(morpholin-4-yl)anilino]-2-[4-(trifluoromethoxy)phenyl]-2H-1,2,3-triazol-4-yl}ethan-1-one
1-{5-[3-chloro-2-(morpholin-4-yl)anilino]-2-[4-(trifluoromethoxy)phenyl]-2H-1,2,3-triazol-4-yl}ethan-1-one
Compound characteristics
| Compound ID: | D216-0096 |
| Compound Name: | 1-{5-[3-chloro-2-(morpholin-4-yl)anilino]-2-[4-(trifluoromethoxy)phenyl]-2H-1,2,3-triazol-4-yl}ethan-1-one |
| Molecular Weight: | 481.86 |
| Molecular Formula: | C21 H19 Cl F3 N5 O3 |
| Smiles: | CC(c1c(Nc2cccc(c2N2CCOCC2)[Cl])nn(c2ccc(cc2)OC(F)(F)F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6314 |
| logD: | 4.6314 |
| logSw: | -4.6832 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.718 |
| InChI Key: | GOOVLWOTHTZWPB-UHFFFAOYSA-N |