Found 1 result

Search term: CC(C)(C(N)=O)C(=O)NCCCNc1nc(Nc2cccc(NC(=O)N3CCCC3)c2)ncc1Br (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | BX-320 | C23H31BrN8O3

BX-320

  • Molecular FormulaC23H31BrN8O3
  • Average mass547.448 Da
  • Monoisotopic mass546.170227 Da
  • ChemSpider ID571329

More details:

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

702676-93-5 [RN]
B504GXS5SM
BX-320
N-(3-{[5-Brom-2-({3-[(1-pyrrolidinylcarbonyl)amino]phenyl}amino)-4-pyrimidinyl]amino}propyl)-2,2-dimethylmalonamid [German] [ACD/IUPAC Name]
N-(3-{[5-Bromo-2-({3-[(1-pyrrolidinylcarbonyl)amino]phenyl}amino)-4-pyrimidinyl]amino}propyl)-2,2-dimethylmalonamide [ACD/IUPAC Name]
N-(3-{[5-Bromo-2-({3-[(1-pyrrolidinylcarbonyl)amino]phényl}amino)-4-pyrimidinyl]amino}propyl)-2,2-diméthylmalonamide [French] [ACD/IUPAC Name]
N'-(3-{[5-bromo-2-({3-[(pyrrolidine-1-carbonyl)amino]phenyl}amino)pyrimidin-4-yl]amino}propyl)-2,2-dimethylpropanediamide
Propanediamide, N1-[3-[[5-bromo-2-[[3-[(1-pyrrolidinylcarbonyl)amino]phenyl]amino]-4-pyrimidinyl]amino]propyl]-2,2-dimethyl- [ACD/Index Name]
BX320
LI8
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.673
Molar Refractivity: 138.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 0.11
ACD/LogD (pH 5.5): 1.20
ACD/BCF (pH 5.5): 4.58
ACD/KOC (pH 5.5): 97.20
ACD/LogD (pH 7.4): 1.30
ACD/BCF (pH 7.4): 5.69
ACD/KOC (pH 7.4): 120.60
Polar Surface Area: 154 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 75.8±3.0 dyne/cm
Molar Volume: 368.8±3.0 cm3

Click to predict properties on the Chemicalize site


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