ChemSpider 2D Image | (2R,4S)-4-{[(4-Azidophenyl)acetyl]amino}-5,7-dichloro-1,2,3,4-tetrahydro-2-quinolinecarboxylic acid | C18H15Cl2N5O3

(2R,4S)-4-{[(4-Azidophenyl)acetyl]amino}-5,7-dichloro-1,2,3,4-tetrahydro-2-quinolinecarboxylic acid

  • Molecular FormulaC18H15Cl2N5O3
  • Average mass420.249 Da
  • Monoisotopic mass419.055206 Da
  • ChemSpider ID115285135

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,4S)-4-{[(4-Azidophenyl)acetyl]amino}-5,7-dichlor-1,2,3,4-tetrahydro-2-chinolincarbonsäure [German] [ACD/IUPAC Name]
(2R,4S)-4-{[(4-Azidophenyl)acetyl]amino}-5,7-dichloro-1,2,3,4-tetrahydro-2-quinolinecarboxylic acid [ACD/IUPAC Name]
2-Quinolinecarboxylic acid, 4-[[2-(4-azidophenyl)acetyl]amino]-5,7-dichloro-1,2,3,4-tetrahydro-, (2R,4S)- [ACD/Index Name]
Acide (2R,4S)-4-{[2-(4-azidophényl)acétyl]amino}-5,7-dichloro-1,2,3,4-tétrahydro-2-quinoléinecarboxylique [French] [ACD/IUPAC Name]
(2R,4S)-4-[[2-(4-azidophenyl)acetyl]amino]-5,7-dichloro-1,2,3,4-tetrahydroquinoline-2-carboxylic acid
208928-25-0 [RN]
4α-[(4-Azidophenyl)acetylamino]-5,7-dichloro-1,2,3,4-tetrahydroquinoline-2β-carboxylic acid
CGP61594

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.60
ACD/LogD (pH 5.5): 1.27
ACD/BCF (pH 5.5): 1.66
ACD/KOC (pH 5.5): 12.31
ACD/LogD (pH 7.4): -0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 91 Å2
Polarizability:
Surface Tension:
Molar Volume:

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