ChemSpider 2D Image | Brostallicin | C30H35BrN12O5

Brostallicin

  • Molecular FormulaC30H35BrN12O5
  • Average mass723.580 Da
  • Monoisotopic mass722.203674 Da
  • ChemSpider ID5293605

More details:

Featured data source
The Merck Index Online

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

1H-Pyrrole-2-carboxamide, 4-[[[4-[(2-bromo-1-oxo-2-propen-1-yl)amino]-1-methyl-1H-pyrrol-2-yl]carbonyl]amino]-N-[5-[[[5-[[[2-[(diaminomethylene)amino]ethyl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amin o]carbonyl]-1-methyl-1H-pyrrol-3-yl]-1-methyl- [ACD/Index Name]
203258-60-0 [RN]
4-[(2-Bromacryloyl)amino]-N-{5-[(5-{[5-({2-[(diaminomethylen)amino]ethyl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}-1-methyl-1H-pyrrol-2- carboxamid [German] [ACD/IUPAC Name]
4-[(2-Bromoacryloyl)amino]-N-{5-[(5-{[5-({2-[(diaminomethylene)amino]ethyl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}-1-methyl-1H-pyrrole -2-carboxamide [ACD/IUPAC Name]
4-[(2-Bromoacryloyl)amino]-N-{5-[(5-{[5-({2-[(diaminométhylène)amino]éthyl}carbamoyl)-1-méthyl-1H-pyrrol-3-yl]carbamoyl}-1-méthyl-1H-pyrrol-3-yl)carbamoyl]-1-méthyl-1H-pyrrol-3-yl}-1-méthyl-1H-pyrrole -2-carboxamide [French] [ACD/IUPAC Name]
brostalicina [Spanish] [INN]
Brostallicin [INN] [Wiki]
brostallicine [French] [INN]
brostallicinum [Latin] [INN]
RPC6R41K4I
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

7988 [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.709
Molar Refractivity: 179.5±0.5 cm3
#H bond acceptors: 17
#H bond donors: 9
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: -2.11
ACD/LogD (pH 5.5): -3.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 230 Å2
Polarizability: 71.2±0.5 10-24cm3
Surface Tension: 63.4±7.0 dyne/cm
Molar Volume: 459.7±7.0 cm3

Click to predict properties on the Chemicalize site


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