4-[(7-Chloro-4-Quinolinyl)Amino]-2,6-Bis(1-Pyrrolidinylmethyl)Phenol

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Properties Simple | Detailed

Formula C25H29ClN4O
IUPAC Name 4-[(7-chloro-4-quinolyl)amino]-2,6-bis(pyrrolidin-1-ylmethyl)phenol
Molecular Mass 436.977 g·mol−1
Heat of Formation 52.7 ± 16.7 kJ·mol−1
Dipole Moment 5.30 ± 1.08 D
Volume 527.26 Å 3
Surface Area 441.8 Å 2
HOMO Energy -8.32 ± 0.55 eV
LUMO Energy -0.79 ± eV
Point Group Symmetry C1
Synonyms
  • 2,6-xylenol, 4-((7-chloro-4-quinolyl)amino)-alpha,alpha'-di-1-pyrrolidinyl-
  • 4-((7-chloro-4-quinolyl)amino)-alpha,alpha'-di-1-pyrrolidinyl-2,6-xylenol
  • 4-(3',5'-bis(pyrrolidinomethyl)-4-hydroxyanilino)-7-chloroquinoline
  • 4-[(7-chloro-4-quinolyl)amino]-2,6-bis(1-pyrrolidinylmethyl)phenol
  • 4-[(7-chloroquinolin-4-yl)amino]-2,6-bis(pyrrolidin-1-ylmethyl)phenol
  • bispyroquine
  • m-6407
  • m6407
  • phenol, 4-((7-chloro-4-quinolinyl)amino)-2,6-bis(1-pyrrolidinylmethyl)-
CAS Number(s)
  • 5201-88-7
InChIKey UNJNCKMZXXZIBE-UHFFFAOYSA-N
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Elements H C N O Cl