ChemSpider 2D Image | N-(2-{[(2S)-2-{5-[(3R)-3-Amino-1-pyrrolidinyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl}-1-piperidinyl]carbonyl}-4-chlorophenyl)methanesulfonamide | C24H30ClN7O3S

N-(2-{[(2S)-2-{5-[(3R)-3-Amino-1-pyrrolidinyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl}-1-piperidinyl]carbonyl}-4-chlorophenyl)methanesulfonamide

  • Molecular FormulaC24H30ClN7O3S
  • Average mass532.058 Da
  • Monoisotopic mass531.181946 Da
  • ChemSpider ID58984407

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1353626-18-2 [RN]
Methanesulfonamide, N-[2-[[(2S)-2-[5-[(3R)-3-amino-1-pyrrolidinyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]-1-piperidinyl]carbonyl]-4-chlorophenyl]- [ACD/Index Name]
N-(2-{[(2S)-2-{5-[(3R)-3-Amino-1-pyrrolidinyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl}-1-piperidinyl]carbonyl}-4-chlorophenyl)methanesulfonamide [ACD/IUPAC Name]
N-(2-{[(2S)-2-{5-[(3R)-3-Amino-1-pyrrolidinyl]-6-méthylpyrazolo[1,5-a]pyrimidin-2-yl}-1-pipéridinyl]carbonyl}-4-chlorophényl)méthanesulfonamide [French] [ACD/IUPAC Name]
N-(2-{[(2S)-2-{5-[(3R)-3-Amino-1-pyrrolidinyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl}-1-piperidinyl]carbonyl}-4-chlorphenyl)methansulfonamid [German] [ACD/IUPAC Name]
N-[2-[[(2S)-2-[5-[(3R)-3-Amino-1-pyrrolidinyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]-1-piperidinyl]carbonyl]-4-chlorophenyl]methanesulfonamide

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.735
Molar Refractivity: 138.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 1.79
ACD/LogD (pH 5.5): -1.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.97
Polar Surface Area: 134 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 64.7±7.0 dyne/cm
Molar Volume: 344.3±7.0 cm3

Click to predict properties on the Chemicalize site


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