ethyl 2-{[5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
ethyl 2-{[5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Compound characteristics
Compound ID: | K061-0561 |
Compound Name: | ethyl 2-{[5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate |
Molecular Weight: | 506.52 |
Molecular Formula: | C22 H17 F3 N4 O3 S2 |
Smiles: | CCOC(c1c2CCCc2sc1NC(c1cc2nc(cc(C(F)(F)F)n2n1)c1cccs1)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.3616 |
logD: | 2.6943 |
logSw: | -5.3525 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.342 |
InChI Key: | JPHYPVBTADYAOF-UHFFFAOYSA-N |