N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-5-(furan-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-5-(furan-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-5-(furan-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | J093-0833 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-5-(furan-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 456.43 |
| Molecular Formula: | C22 H19 F3 N6 O2 |
| Smiles: | C1CN(CCNC(c2nc3nc(cc(C(F)(F)F)n3n2)c2ccco2)=O)Cc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.1208 |
| logD: | 2.7374 |
| logSw: | -3.3072 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.259 |
| InChI Key: | KBSKKNDFFCHKEJ-UHFFFAOYSA-N |