583047-05-6
4'-CHLORO-N-[8-(DIMETHYLAMINO)-2,3,4,5-TETRAHYDRO-3-METHYL-1H-3-BENZAZEPIN-7-YL]-[1,1'-BIPHENYL]-4-SULFONAMIDE
Name4'-CHLORO-N-[8-(DIMETHYLAMINO)-2,3,4,5-TETRAHYDRO-3-METHYL-1H-3-BENZAZEPIN-7-YL]-[1,1'-BIPHENYL]-4-SULFONAMIDE
pro_formulaC25 H28 Cl N3 O2 S
1Identification
【Name】
4'-CHLORO-N-[8-(DIMETHYLAMINO)-2,3,4,5-TETRAHYDRO-3-METHYL-1H-3-BENZAZEPIN-7-YL]-[1,1'-BIPHENYL]-4-SULFONAMIDE
【CAS】
【MDL】
MFCD19443667
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C25 H28 Cl N3 O2 S
【pro_molWeight】
470.034
【Inchi】
InChI=1S/C25H28ClN3O2S/c1-28(2)25-17-21-13-15-29(3)14-12-20(21)16-24(25)27-32(30,31)23-10-6-19(7-11-23)18-4-8-22(26)9-5-18/h4-11,16-17,27H,12-15H2,1-3H3
【InChIKey】
InChIKey=YIEYRURKJGPPJJ-UHFFFAOYSA-N
【SMILES】
CN1CCc2cc(c(cc2CC1)N(C)C)NS(=O)(=O)c3ccc(cc3)c4ccc(cc4)Cl
【MOL File】
4'-CHLORO-N-[8-(DIME….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:5
XLogP3:5.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4'-CHLORO-N-[8-(DIMETHYLAMINO)-2,3,4,5-TETRAHYDRO-3-METHYL-1H-3-BENZAZEPIN-7-YL]-[1,1'-BIPHENYL]-4-SULFONAMIDE.cml