ChemSpider 2D Image | 4,5-Anhydro-1-(1-cyclopenten-1-yl)-1,2-dideoxy-4-methyl-2-{[N-(4-morpholinylacetyl)-L-alanyl-(betaR)-beta-hydroxy-O-methyl-L-tyrosyl]amino}-D-erythro-pent-3-ulose | C30H42N4O8

4,5-Anhydro-1-(1-cyclopenten-1-yl)-1,2-dideoxy-4-methyl-2-{[N-(4-morpholinylacetyl)-L-alanyl-(βR)-β-hydroxy-O-methyl-L-tyrosyl]amino}-D-erythro-pent-3-ulose

  • Molecular FormulaC30H42N4O8
  • Average mass586.677 Da
  • Monoisotopic mass586.300293 Da
  • ChemSpider ID78434307

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

4,5-Anhydro-1-(1-cyclopenten-1-yl)-1,2-dideoxy-4-methyl-2-{[N-(4-morpholinylacetyl)-L-alanyl-(βR)-β-hydroxy-O-methyl-L-tyrosyl]amino}-D-erythro-pent-3-ulose [ACD/IUPAC Name]
4,5-Anhydro-1-(1-cyclopentén-1-yl)-1,2-didésoxy-4-méthyl-2-({N-[2-(4-morpholinyl)acétyl]-L-alanyl-(βR)-β-hydroxy-O-méthyl-L-tyrosyl}amino)-D-érythro-pent-3-ulose [French] [ACD/IUPAC Name]
4,5-Anhydro-1-(1-cyclopenten-1-yl)-1,2-didesoxy-4-methyl-2-{[N-(4-morpholinylacetyl)-L-alanyl-(βR)-β-hydroxy-O-methyl-L-tyrosyl]amino}-D-erythro-pent-3-ulose [German] [ACD/IUPAC Name]
D-erythro-3-Pentulose, 4,5-anhydro-1-(1-cyclopenten-1-yl)-1,2-dideoxy-4-C-methyl-2-[[N-[2-(4-morpholinyl)acetyl]-L-alanyl-(βR)-β-hydroxy-O-methyl-L-tyrosyl]amino]- [ACD/Index Name]
(2S,3R)-N-[(2S)-3-(cyclopenten-1-yl)-1-[(2R)-2-methyloxiran-2-yl]-1-oxopropan-2-yl]-3-hydroxy-3-(4-methoxyphenyl)-2-[[(2S)-2-[(2-morpholin-4-ylacetyl)amino]propanoyl]amino]propanamide
1629677-75-3 [RN]
Zetomipzomib

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

KZR-616 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 908.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 138.4±3.0 kJ/mol
Flash Point: 503.2±34.3 °C
Index of Refraction: 1.568
Molar Refractivity: 152.1±0.3 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 3.47
ACD/LogD (pH 5.5): 1.52
ACD/BCF (pH 5.5): 8.07
ACD/KOC (pH 5.5): 148.67
ACD/LogD (pH 7.4): 1.58
ACD/BCF (pH 7.4): 9.35
ACD/KOC (pH 7.4): 172.37
Polar Surface Area: 159 Å2
Polarizability: 60.3±0.5 10-24cm3
Surface Tension: 53.4±3.0 dyne/cm
Molar Volume: 465.0±3.0 cm3

Click to predict properties on the Chemicalize site


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