Found 47 results

Search term: MF = 'C_{27}H_{34}ClN_{7}O_{2}'
ChemSpider 2D Image | 2-{[5-Chloro-2-({4-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-2-ethoxyphenyl}amino)-4-pyrimidinyl]amino}-N-ethylbenzamide | C27H34ClN7O2

2-{[5-Chloro-2-({4-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-2-ethoxyphenyl}amino)-4-pyrimidinyl]amino}-N-ethylbenzamide

  • Molecular FormulaC27H34ClN7O2
  • Average mass524.058 Da
  • Monoisotopic mass523.246277 Da
  • ChemSpider ID9866896

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-{[5-Chlor-2-({4-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-2-ethoxyphenyl}amino)-4-pyrimidinyl]amino}-N-ethylbenzamid [German] [ACD/IUPAC Name]
2-{[5-Chloro-2-({4-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-2-ethoxyphenyl}amino)-4-pyrimidinyl]amino}-N-ethylbenzamide [ACD/IUPAC Name]
2-{[5-Chloro-2-({4-[(3S)-3-(diméthylamino)-1-pyrrolidinyl]-2-éthoxyphényl}amino)-4-pyrimidinyl]amino}-N-éthylbenzamide [French] [ACD/IUPAC Name]
Benzamide, 2-[[5-chloro-2-[[4-[(3S)-3-(dimethylamino)-1-pyrrolidinyl]-2-ethoxyphenyl]amino]-4-pyrimidinyl]amino]-N-ethyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.645
Molar Refractivity: 146.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 1.51
ACD/BCF (pH 5.5): 1.59
ACD/KOC (pH 5.5): 6.91
ACD/LogD (pH 7.4): 2.89
ACD/BCF (pH 7.4): 38.61
ACD/KOC (pH 7.4): 168.19
Polar Surface Area: 95 Å2
Polarizability: 57.9±0.5 10-24cm3
Surface Tension: 65.1±5.0 dyne/cm
Molar Volume: 403.0±5.0 cm3

Click to predict properties on the Chemicalize site


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