Found 2 results

Search term: MF = 'C_{32}H_{42}N_{3}O_{4}'
ChemSpider 2D Image | 3-Amino-N-(3-aminopropyl)-N-({4'-[(2S,3S)-2,3-dicarboxy-4-phenylbutyl]-4-biphenylyl}methyl)-N-methyl-1-propanaminium | C32H42N3O4

3-Amino-N-(3-aminopropyl)-N-({4'-[(2S,3S)-2,3-dicarboxy-4-phenylbutyl]-4-biphenylyl}methyl)-N-methyl-1-propanaminium

  • Molecular FormulaC32H42N3O4
  • Average mass532.693 Da
  • Monoisotopic mass532.316956 Da
  • ChemSpider ID8071335

  • Charge - Charge

    defined stereocentres - 2 of 2 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

[1,1'-Biphenyl]-4-methanaminium, N,N-bis(3-aminopropyl)-4'-[(2S,3S)-2,3-dicarboxy-4-phenylbutyl]-N-methyl- [ACD/Index Name]
3-Amino-N-(3-aminopropyl)-N-({4'-[(2S,3S)-2,3-dicarboxy-4-phenylbutyl]-4-biphenylyl}methyl)-N-methyl-1-propanaminium [ACD/IUPAC Name]
3-Amino-N-(3-aminopropyl)-N-({4'-[(2S,3S)-2,3-dicarboxy-4-phenylbutyl]-4-biphenylyl}methyl)-N-methyl-1-propanaminium [German] [ACD/IUPAC Name]
3-Amino-N-(3-aminopropyl)-N-({4'-[(2S,3S)-2,3-dicarboxy-4-phénylbutyl]-4-biphénylyl}méthyl)-N-méthyl-1-propanaminium [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: -1.23
ACD/LogD (pH 5.5): -2.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.70
Polar Surface Area: 127 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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