N-[4-(propan-2-yl)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[4-(propan-2-yl)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-[4-(propan-2-yl)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | J093-0960 |
Compound Name: | N-[4-(propan-2-yl)phenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 431.44 |
Molecular Formula: | C20 H16 F3 N5 O S |
Smiles: | CC(C)c1ccc(cc1)NC(c1nc2nc(cc(C(F)(F)F)n2n1)c1cccs1)=O |
Stereo: | ACHIRAL |
logP: | 5.3953 |
logD: | 5.3953 |
logSw: | -5.4372 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.891 |
InChI Key: | IJOJCGFWZCHHFK-UHFFFAOYSA-N |