ChemSpider 2D Image | 6-[2-Chloro-4-(6-methyl-2-pyrazinyl)phenyl]-8-ethyl-2-({2-[(4S)-1-methyl-1,2,3,4-tetrahydro-4-pyridinyl]ethyl}amino)pyrido[2,3-d]pyrimidin-7(8H)-one | C28H30ClN7O

6-[2-Chloro-4-(6-methyl-2-pyrazinyl)phenyl]-8-ethyl-2-({2-[(4S)-1-methyl-1,2,3,4-tetrahydro-4-pyridinyl]ethyl}amino)pyrido[2,3-d]pyrimidin-7(8H)-one

  • Molecular FormulaC28H30ClN7O
  • Average mass516.037 Da
  • Monoisotopic mass515.220032 Da
  • ChemSpider ID61709894

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2E)-6-[2-Chlor-4-(6-methyl-2-pyrazinyl)phenyl]-8-ethyl-2-({2-[(4R)-1-methyl-1,2,3,4-tetrahydro-4-pyridinyl]ethyl}imino)-2,8-dihydropyrido[2,3-d]pyrimidin-7(3H)-on [German] [ACD/IUPAC Name]
(2E)-6-[2-Chloro-4-(6-methyl-2-pyrazinyl)phenyl]-8-ethyl-2-({2-[(4R)-1-methyl-1,2,3,4-tetrahydro-4-pyridinyl]ethyl}imino)-2,8-dihydropyrido[2,3-d]pyrimidin-7(3H)-one [ACD/IUPAC Name]
(2E)-6-[2-Chloro-4-(6-méthyl-2-pyrazinyl)phényl]-8-éthyl-2-({2-[(4R)-1-méthyl-1,2,3,4-tétrahydro-4-pyridinyl]éthyl}imino)-2,8-dihydropyrido[2,3-d]pyrimidin-7(3H)-one [French] [ACD/IUPAC Name]
6-[2-Chlor-4-(6-methyl-2-pyrazinyl)phenyl]-8-ethyl-2-({2-[(4S)-1-methyl-1,2,3,4-tetrahydro-4-pyridinyl]ethyl}amino)pyrido[2,3-d]pyrimidin-7(8H)-on [German] [ACD/IUPAC Name]
6-[2-Chloro-4-(6-methyl-2-pyrazinyl)phenyl]-8-ethyl-2-({2-[(4S)-1-methyl-1,2,3,4-tetrahydro-4-pyridinyl]ethyl}amino)pyrido[2,3-d]pyrimidin-7(8H)-one [ACD/IUPAC Name]
6-[2-Chloro-4-(6-méthyl-2-pyrazinyl)phényl]-8-éthyl-2-({2-[(4S)-1-méthyl-1,2,3,4-tétrahydro-4-pyridinyl]éthyl}amino)pyrido[2,3-d]pyrimidin-7(8H)-one [French] [ACD/IUPAC Name]
Pyrido[2,3-d]pyrimidin-7(3H)-one, 6-[2-chloro-4-(6-methyl-2-pyrazinyl)phenyl]-8-ethyl-2,8-dihydro-2-[[2-[(4R)-1,2,3,4-tetrahydro-1-methyl-4-pyridinyl]ethyl]imino]-, (2E)- [ACD/Index Name]
Pyrido[2,3-d]pyrimidin-7(8H)-one, 6-[2-chloro-4-(6-methyl-2-pyrazinyl)phenyl]-8-ethyl-2-[[2-[(4S)-1,2,3,4-tetrahydro-1-methyl-4-pyridinyl]ethyl]amino]- [ACD/Index Name]
59U
6-[2-Chloro-4-(6-Methylpyrazin-2-Yl)phenyl]-8-Ethyl-2-{[2-(1-Methylpiperidin-4-Yl)ethyl]amino}pyrido[2,3-D]pyrimidin-7(8h)-One

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

Density: 1.3±0.1 g/cm3
Boiling Point: 690.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.2±3.0 kJ/mol
Flash Point: 371.3±34.3 °C
Index of Refraction: 1.679
Molar Refractivity: 146.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.08
ACD/LogD (pH 5.5): 1.02
ACD/BCF (pH 5.5): 1.01
ACD/KOC (pH 5.5): 8.07
ACD/LogD (pH 7.4): 1.28
ACD/BCF (pH 7.4): 1.83
ACD/KOC (pH 7.4): 14.60
Polar Surface Area: 86 Å2
Polarizability: 58.2±0.5 10-24cm3
Surface Tension: 51.1±7.0 dyne/cm
Molar Volume: 389.3±7.0 cm3

Click to predict properties on the Chemicalize site


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