2,2'-(hexane-1,6-diylbis(methylazanediyl))bis(N-(2,6-dimethylphenyl)acetamide) | SBID = 2643 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 1
PubChem TPSA/Å2:
Ertl TPSA/Å2: 64.68
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3): 4.99
Charge: 0.0
Number of H-Bond Donors: 0.0
Number of H-Bond Acceptors: 0.0
Number of Stereogenic Bonds (E/Z):
Number of Stereogenic Atoms (R/S):
3D Volume/Å3:
Sum Formula: C28H42N4O2
M / g/mol: 466.65868
Complexity:
Number of Conformers:

Identifiers

  • Tags:
  • Name: 2,2'-(hexane-1,6-diylbis(methylazanediyl))bis(N-(2,6-dimethylphenyl)acetamide)
  • Preferred Abbreviation: 2,2'-(hexane-1,6-diylbis(methylazanediyl))bis(N-(2,6-dimethylphenyl)acetamide)
  • IUPAC Name:
  • CAS:
  • CID: -1182
  • InChiKey: RRYKWJOUPNICQE-UHFFFAOYSA-N
  • InChi: InChI=1S/C28H42N4O2/c1-21-13-11-14-22(2)27(21)29-25(33)19-31(5)17-9-7-8-10-18-32(6)20-26(34)30-28-23(3)15-12-16-24(28)4/h11-16H,7-10,17-20H2,1-6H3,(H,29,33)(H,30,34)
  • CanoSmiles: CN(CC(=O)Nc1c(C)cccc1C)CCCCCCN(CC(=O)Nc1c(C)cccc1C)C
  • IsoSmiles: CC1=C(NC(CN(C)CCCCCCN(C)CC(NC2=C(C)C=CC=C2C)=O)=O)C(C)=CC=C1