ChemSpider 2D Image | 1-[2-(2-{[2-(Dimethylamino)ethyl]amino}-6-[2-(isopropylamino)-1,3-thiazol-5-yl]-4-pyrimidinyl)benzyl]-3-ethylurea | C24H34N8OS

1-[2-(2-{[2-(Dimethylamino)ethyl]amino}-6-[2-(isopropylamino)-1,3-thiazol-5-yl]-4-pyrimidinyl)benzyl]-3-ethylurea

  • Molecular FormulaC24H34N8OS
  • Average mass482.645 Da
  • Monoisotopic mass482.257629 Da
  • ChemSpider ID25058978

More details:






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

1-[2-(2-{[2-(Dimethylamino)ethyl]amino}-6-[2-(isopropylamino)-1,3-thiazol-5-yl]-4-pyrimidinyl)benzyl]-3-ethylharnstoff [German] [ACD/IUPAC Name]
1-[2-(2-{[2-(Dimethylamino)ethyl]amino}-6-[2-(isopropylamino)-1,3-thiazol-5-yl]-4-pyrimidinyl)benzyl]-3-ethylurea [ACD/IUPAC Name]
1-[2-(2-{[2-(Diméthylamino)éthyl]amino}-6-[2-(isopropylamino)-1,3-thiazol-5-yl]-4-pyrimidinyl)benzyl]-3-éthylurée [French] [ACD/IUPAC Name]
1-[2-(2-{[2-(Dimethylamino)ethyl]amino}-6-{2-[(1-Methylethyl)amino]-1,3-Thiazol-5-Yl}pyrimidin-4-Yl)benzyl]-3-Ethylurea
Urea, N-[[2-[2-[[2-(dimethylamino)ethyl]amino]-6-[2-[(1-methylethyl)amino]-5-thiazolyl]-4-pyrimidinyl]phenyl]methyl]-N'-ethyl- [ACD/Index Name]
3NW

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.621
Molar Refractivity: 140.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.48
ACD/LogD (pH 5.5): 0.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.60
ACD/LogD (pH 7.4): 1.75
ACD/BCF (pH 7.4): 5.89
ACD/KOC (pH 7.4): 50.11
Polar Surface Area: 135 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 53.1±3.0 dyne/cm
Molar Volume: 398.8±3.0 cm3

Click to predict properties on the Chemicalize site






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