ChemSpider 2D Image | 4-Formamido-N-{1-isopropyl-5-[(1-methyl-5-{[3-(4-morpholinyl)propyl]carbamoyl}-1H-pyrrol-3-yl)carbamoyl]-1H-pyrrol-3-yl}-1-methyl-1H-pyrrole-2-carboxamide | C28H38N8O5

4-Formamido-N-{1-isopropyl-5-[(1-methyl-5-{[3-(4-morpholinyl)propyl]carbamoyl}-1H-pyrrol-3-yl)carbamoyl]-1H-pyrrol-3-yl}-1-methyl-1H-pyrrole-2-carboxamide

  • Molecular FormulaC28H38N8O5
  • Average mass566.652 Da
  • Monoisotopic mass566.296509 Da
  • ChemSpider ID2279167

More details:

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

1H-Pyrrole-2-carboxamide, 4-[[[4-(formylamino)-1-methyl-1H-pyrrol-2-yl]carbonyl]amino]-1-(1-methylethyl)-N-[1-methyl-5-[[[3-(4-morpholinyl)propyl]amino]carbonyl]-1H-pyrrol-3-yl]- [ACD/Index Name]
4-(formylamino)-1-methyl-N-{5-[(1-methyl-5-{[3-(morpholin-4-yl)propyl]carbamoyl}-1H-pyrrol-3-yl)carbamoyl]-1-(propan-2-yl)-1H-pyrrol-3-yl}-1H-pyrrole-2-carboxamide
4-Formamido-N-{1-isopropyl-5-[(1-methyl-5-{[3-(4-morpholinyl)propyl]carbamoyl}-1H-pyrrol-3-yl)carbamoyl]-1H-pyrrol-3-yl}-1-methyl-1H-pyrrol-2-carboxamid [German] [ACD/IUPAC Name]
4-Formamido-N-{1-isopropyl-5-[(1-methyl-5-{[3-(4-morpholinyl)propyl]carbamoyl}-1H-pyrrol-3-yl)carbamoyl]-1H-pyrrol-3-yl}-1-methyl-1H-pyrrole-2-carboxamide [ACD/IUPAC Name]
4-Formamido-N-{1-isopropyl-5-[(1-méthyl-5-{[3-(4-morpholinyl)propyl]carbamoyl}-1H-pyrrol-3-yl)carbamoyl]-1H-pyrrol-3-yl}-1-méthyl-1H-pyrrole-2-carboxamide [French] [ACD/IUPAC Name]
1H-Pyrrole-2-carboxamide, 4-(formylamino)-1-methyl-N-[1-(1-methylethyl)-5-[[[1-methyl-5-[[[3-(4-morpholinyl)propyl]amino]carbonyl]-1H-pyrrol-3-yl]amino]carbonyl]-1H-pyrrol-3-yl]-
2N-[3-(1,4-oxazinan-4-yl)propyl]-4-[4-(4-formamido-1-methyl-1H-2-pyrrolylcarboxamido)-1-isopropyl-1H-2-pyrrolylcarboxamido]-1-methyl-1H-2-pyrrolecarboxamide

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

AIDS211382 [DBID]
AIDS-211382 [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: 728.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.3±3.0 kJ/mol
Flash Point: 394.3±32.9 °C
Index of Refraction: 1.647
Molar Refractivity: 153.5±0.5 cm3
#H bond acceptors: 13
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: -0.50
ACD/LogD (pH 5.5): -1.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 24.13
Polar Surface Area: 144 Å2
Polarizability: 60.8±0.5 10-24cm3
Surface Tension: 53.6±7.0 dyne/cm
Molar Volume: 422.6±7.0 cm3

Click to predict properties on the Chemicalize site


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