1-{5-[(2,3-dihydro-1H-inden-1-yl)amino]-2-[4-(trifluoromethoxy)phenyl]-2H-1,2,3-triazol-4-yl}ethan-1-one
Chemical Structure Depiction of
1-{5-[(2,3-dihydro-1H-inden-1-yl)amino]-2-[4-(trifluoromethoxy)phenyl]-2H-1,2,3-triazol-4-yl}ethan-1-one
1-{5-[(2,3-dihydro-1H-inden-1-yl)amino]-2-[4-(trifluoromethoxy)phenyl]-2H-1,2,3-triazol-4-yl}ethan-1-one
Compound characteristics
| Compound ID: | D216-0041 |
| Compound Name: | 1-{5-[(2,3-dihydro-1H-inden-1-yl)amino]-2-[4-(trifluoromethoxy)phenyl]-2H-1,2,3-triazol-4-yl}ethan-1-one |
| Molecular Weight: | 402.37 |
| Molecular Formula: | C20 H17 F3 N4 O2 |
| Smiles: | CC(c1c(NC2CCc3ccccc23)nn(c2ccc(cc2)OC(F)(F)F)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.533 |
| logD: | 4.533 |
| logSw: | -4.2904 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.189 |
| InChI Key: | PBILSRZBMPCORU-KRWDZBQOSA-N |