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Search term: MYLORHMOQIOMFF-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 3-Fluoro-2-methyl-N-[5-(5H-pyrrolo[2,1-c][1,4]benzodiazepin-10(11H)-ylcarbonyl)-2-pyridinyl]benzamide | C26H21FN4O2

3-Fluoro-2-methyl-N-[5-(5H-pyrrolo[2,1-c][1,4]benzodiazepin-10(11H)-ylcarbonyl)-2-pyridinyl]benzamide

  • Molecular FormulaC26H21FN4O2
  • Average mass440.469 Da
  • Monoisotopic mass440.164856 Da
  • ChemSpider ID23143754

More details:

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

3-Fluor-2-methyl-N-[5-(5H-pyrrolo[2,1-c][1,4]benzodiazepin-10(11H)-ylcarbonyl)-2-pyridinyl]benzamid [German] [ACD/IUPAC Name]
3-Fluoro-2-methyl-N-[5-(5H-pyrrolo[2,1-c][1,4]benzodiazepin-10(11H)-ylcarbonyl)-2-pyridinyl]benzamide [ACD/IUPAC Name]
3-Fluoro-2-méthyl-N-[5-(5H-pyrrolo[2,1-c][1,4]benzodiazépin-10(11H)-ylcarbonyl)-2-pyridinyl]benzamide [French] [ACD/IUPAC Name]
Benzamide, 3-fluoro-2-methyl-N-[5-(5H-pyrrolo[2,1-c][1,4]benzodiazepin-10(11H)-ylcarbonyl)-2-pyridinyl]- [ACD/Index Name]
CHEMBL46295
N-[5-(5H,11H-Benzo[e]pyrrolo[1,2-a][1,4]diazepine-10-carbonyl)-pyridin-2-yl]-3-fluoro-2-methyl-benzamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 619.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.8±3.0 kJ/mol
Flash Point: 328.3±31.5 °C
Index of Refraction: 1.667
Molar Refractivity: 125.0±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.59
ACD/LogD (pH 5.5): 4.34
ACD/BCF (pH 5.5): 1167.50
ACD/KOC (pH 5.5): 5459.23
ACD/LogD (pH 7.4): 4.34
ACD/BCF (pH 7.4): 1167.32
ACD/KOC (pH 7.4): 5458.41
Polar Surface Area: 67 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 50.7±7.0 dyne/cm
Molar Volume: 335.8±7.0 cm3

Click to predict properties on the Chemicalize site


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