957194-91-1
1-(5-CHLORO-2-(TRIFLUOROMETHYL)BENZYL)-7-(6-(4-METHYLPIPERAZIN-1-YL)PYRIDIN-3-YL)-1,2,3,4-TETRAHYDROPYRIDO[2,3-B]PYRAZINE
Name1-(5-CHLORO-2-(TRIFLUOROMETHYL)BENZYL)-7-(6-(4-METHYLPIPERAZIN-1-YL)PYRIDIN-3-YL)-1,2,3,4-TETRAHYDROPYRIDO[2,3-B]PYRAZINE
pro_formulaC25 H26 Cl F3 N6
1Identification
【Name】
1-(5-CHLORO-2-(TRIFLUOROMETHYL)BENZYL)-7-(6-(4-METHYLPIPERAZIN-1-YL)PYRIDIN-3-YL)-1,2,3,4-TETRAHYDROPYRIDO[2,3-B]PYRAZINE
【CAS】
【MDL】
MFCD18206325
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C25 H26 Cl F3 N6
【pro_molWeight】
502.969
【Inchi】
InChI=1S/C25H26ClF3N6/c1-33-8-10-34(11-9-33)23-5-2-17(14-31-23)18-13-22-24(32-15-18)30-6-7-35(22)16-19-12-20(26)3-4-21(19)25(27,28)29/h2-5,12-15H,6-11,16H2,1H3,(H,30,32)
【InChIKey】
InChIKey=LJKJYKWDLJUZHA-UHFFFAOYSA-N
【SMILES】
CN1CCN(CC1)c2ccc(cn2)c3cc4c(nc3)NCCN4Cc5cc(ccc5C(F)(F)F)Cl
【MOL File】
1-(5-CHLORO-2-(TRIFL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:6
XLogP3:5.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-(5-CHLORO-2-(TRIFLUOROMETHYL)BENZYL)-7-(6-(4-METHYLPIPERAZIN-1-YL)PYRIDIN-3-YL)-1,2,3,4-TETRAHYDROPYRIDO[2,3-B]PYRAZINE.cml