Found 1 result

Search term: MF = 'C_{24}H_{36}BrClN_{8}O_{3}'
ChemSpider 2D Image | 3,5-Diamino-N-{2-[{3-[(2-{[3-bromo-2-hydroxy-5-(2-methyl-2-propanyl)benzyl]amino}ethyl)amino]-3-oxopropyl}(methyl)amino]ethyl}-6-chloro-2-pyrazinecarboxamide | C24H36BrClN8O3

3,5-Diamino-N-{2-[{3-[(2-{[3-bromo-2-hydroxy-5-(2-methyl-2-propanyl)benzyl]amino}ethyl)amino]-3-oxopropyl}(methyl)amino]ethyl}-6-chloro-2-pyrazinecarboxamide

  • Molecular FormulaC24H36BrClN8O3
  • Average mass599.951 Da
  • Monoisotopic mass598.178223 Da
  • ChemSpider ID114277

More details:

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

2-Pyrazinecarboxamide, 3,5-diamino-N-[2-[[3-[[2-[[[3-bromo-5-(1,1-dimethylethyl)-2-hydroxyphenyl]methyl]amino]ethyl]amino]-3-oxopropyl]methylamino]ethyl]-6-chloro- [ACD/Index Name]
3,5-Diamino-N-{2-[{3-[(2-{[3-brom-2-hydroxy-5-(2-methyl-2-propanyl)benzyl]amino}ethyl)amino]-3-oxopropyl}(methyl)amino]ethyl}-6-chlor-2-pyrazincarboxamid [German] [ACD/IUPAC Name]
3,5-Diamino-N-{2-[{3-[(2-{[3-bromo-2-hydroxy-5-(2-methyl-2-propanyl)benzyl]amino}ethyl)amino]-3-oxopropyl}(methyl)amino]ethyl}-6-chloro-2-pyrazinecarboxamide [ACD/IUPAC Name]
3,5-Diamino-N-{2-[{3-[(2-{[3-bromo-2-hydroxy-5-(2-méthyl-2-propanyl)benzyl]amino}éthyl)amino]-3-oxopropyl}(méthyl)amino]éthyl}-6-chloro-2-pyrazinecarboxamide [French] [ACD/IUPAC Name]
119778-11-9 [RN]
Ici-207,828
N-(2-(3-Bromo-5-tert-butyl-2-hydroxybenzylamino)ethyl)-3-(N-2-(3,4-diamino-6-chloropyrazin-2-ylcarboxamido)ethyl)-N-methylaminopropionamide
N-(2-{[(3-BROMO-5-TERT-BUTYL-2-HYDROXYPHENYL)METHYL]AMINO}ETHYL)-3-({2-[(3,5-DIAMINO-6-CHLOROPYRAZIN-2-YL)FORMAMIDO]ETHYL}(METHYL)AMINO)PROPANAMIDE
Pyrazinecarboxamide, 3,5-diamino-N-(2-((3-((2-(((3-bromo-5-(1,1-dimethylethyl)-2-hydroxyphenyl)methyl)amino)ethyl)amino)-3-oxopropyl)methylamino)ethyl)-6-chloro-

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

Ici 207828 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 763.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.0±3.0 kJ/mol
Flash Point: 415.2±32.9 °C
Index of Refraction: 1.616
Molar Refractivity: 149.9±0.3 cm3
#H bond acceptors: 11
#H bond donors: 8
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 4
ACD/LogP: 6.15
ACD/LogD (pH 5.5): 0.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.52
ACD/BCF (pH 7.4): 20.79
ACD/KOC (pH 7.4): 111.47
Polar Surface Area: 172 Å2
Polarizability: 59.4±0.5 10-24cm3
Surface Tension: 58.7±3.0 dyne/cm
Molar Volume: 428.8±3.0 cm3

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