ChemSpider 2D Image | 3'-{[N-(4-Azido-2-nitrobenzoyl)-O-methyl-L-tyrosyl]amino}-3'-deoxy-N,N-dimethyladenosine | C29H32N11O8

3'-{[N-(4-Azido-2-nitrobenzoyl)-O-methyl-L-tyrosyl]amino}-3'-deoxy-N,N-dimethyladenosine

  • Molecular FormulaC29H32N11O8
  • Average mass661.625 Da
  • Monoisotopic mass661.235718 Da
  • ChemSpider ID2301278
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

3'-{[N-(4-Azido-2-nitrobenzoyl)-O-methyl-L-tyrosyl]amino}-3'-deoxy-N,N-dimethyladenosine [ACD/IUPAC Name]
3'-{[N-(4-Azido-2-nitrobenzoyl)-O-methyl-L-tyrosyl]amino}-3'-desoxy-N,N-dimethyladenosin [German] [ACD/IUPAC Name]
3'-{[N-(4-Azido-2-nitrobenzoyl)-O-méthyl-L-tyrosyl]amino}-3'-désoxy-N,N-diméthyladénosine [French] [ACD/IUPAC Name]
Adenosine, 3'-[[(2S)-2-[(4-azido-2-nitrobenzoyl)amino]-3-(4-methoxyphenyl)-1-oxopropyl]amino]-3'-deoxy-N,N-dimethyl- [ACD/Index Name]
73579-23-4 [RN]
Adenosine, 3'-((2-((4-azido-2-nitrobenzoyl)amino)-3-(4-methoxyphenyl)-1-oxopropyl)amino)-3'-deoxy-N,N-dimethyl-, (S)-
N-(2-Nitro-4-azidobenzoyl)puromycin

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 19
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 3.86
ACD/LogD (pH 5.5): 2.42
ACD/BCF (pH 5.5): 39.70
ACD/KOC (pH 5.5): 471.95
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 43.65
ACD/KOC (pH 7.4): 518.89
Polar Surface Area: 222 Å2
Polarizability:
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