78156-00-0
1-(3-(DIMETHYLAMINO)PROPYL)-3-METHYL-6-(TRIFLUOROMETHYL)-2(1H)-QUINOXALINONE
Name1-(3-(DIMETHYLAMINO)PROPYL)-3-METHYL-6-(TRIFLUOROMETHYL)-2(1H)-QUINOXALINONE
pro_formulaC15 H18 F3 N3 O
1Identification
【Name】
1-(3-(DIMETHYLAMINO)PROPYL)-3-METHYL-6-(TRIFLUOROMETHYL)-2(1H)-QUINOXALINONE
【CAS】
【MDL】
MFCD01684884
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C15 H18 F3 N3 O
【pro_molWeight】
313.321
【Inchi】
InChI=1S/C15H18F3N3O/c1-10-14(22)21(8-4-7-20(2)3)13-6-5-11(15(16,17)18)9-12(13)19-10/h5-6,9H,4,7-8H2,1-3H3
【InChIKey】
InChIKey=VYWVDPPCGFGBMW-UHFFFAOYSA-N
【SMILES】
Cc1c(=O)n(c2ccc(cc2n1)C(F)(F)F)CCCN(C)C
【MOL File】
1-(3-(DIMETHYLAMINO)….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:4
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-(3-(DIMETHYLAMINO)PROPYL)-3-METHYL-6-(TRIFLUOROMETHYL)-2(1H)-QUINOXALINONE.cml