ChemSpider 2D Image | MK-7246 | C21H21FN2O4S

MK-7246

  • Molecular FormulaC21H21FN2O4S
  • Average mass416.466 Da
  • Monoisotopic mass416.120605 Da
  • ChemSpider ID24626991

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(7-{[(4-Fluorophenyl)sulfonyl](methyl)amino}-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl)acetic acid [ACD/IUPAC Name]
(7-{[(4-Fluorphenyl)sulfonyl](methyl)amino}-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl)essigsäure [German] [ACD/IUPAC Name]
(R)-2-(7-(4-Fluoro-N-methylphenylsulfonamido)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl)acetic acid
1218918-62-7 [RN]
Acide (7-{[(4-fluorophényl)sulfonyl](méthyl)amino}-6,7,8,9-tétrahydropyrido[1,2-a]indol-10-yl)acétique [French] [ACD/IUPAC Name]
MK-7246
Pyrido[1,2-a]indole-10-acetic acid, 7-[[(4-fluorophenyl)sulfonyl]methylamino]-6,7,8,9-tetrahydro- [ACD/Index Name]
X0LHZ71TLK
(7r)-7-[[(4-fluorophenyl)sulfonyl]methylamino]-6,7,8,9-tetrahydropyrido[1,2-a]indole-10-acetic acid
[(7R)-7-(N-methyl-4-fluorobenzenesulfonamido)-6H,7H,8H,9H-pyrido[1,2-a]indol-10-yl]acetic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 636.5±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 98.8±3.0 kJ/mol
    Flash Point: 338.7±34.3 °C
    Index of Refraction: 1.655
    Molar Refractivity: 108.2±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.84
    ACD/LogD (pH 5.5): 2.88
    ACD/BCF (pH 5.5): 51.26
    ACD/KOC (pH 5.5): 294.96
    ACD/LogD (pH 7.4): 1.08
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 4.65
    Polar Surface Area: 88 Å2
    Polarizability: 42.9±0.5 10-24cm3
    Surface Tension: 54.0±7.0 dyne/cm
    Molar Volume: 294.9±7.0 cm3

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