ChemSpider 2D Image | N-{[1-(3-Chlorobenzyl)-4-piperidinyl]methyl}-2-(1,3-diethyl-2,4-dioxo-1,2,3,4-tetrahydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)acetamide | C25H32ClN5O3

N-{[1-(3-Chlorobenzyl)-4-piperidinyl]methyl}-2-(1,3-diethyl-2,4-dioxo-1,2,3,4-tetrahydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)acetamide

  • Molecular FormulaC25H32ClN5O3
  • Average mass486.006 Da
  • Monoisotopic mass485.219360 Da
  • ChemSpider ID29179772

More details:

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

7H-Pyrrolo[2,3-d]pyrimidine-7-acetamide, N-[[1-[(3-chlorophenyl)methyl]-4-piperidinyl]methyl]-1,3-diethyl-1,2,3,4-tetrahydro-2,4-dioxo- [ACD/Index Name]
N-{[1-(3-Chlorbenzyl)-4-piperidinyl]methyl}-2-(1,3-diethyl-2,4-dioxo-1,2,3,4-tetrahydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)acetamid [German] [ACD/IUPAC Name]
N-{[1-(3-Chlorobenzyl)-4-piperidinyl]methyl}-2-(1,3-diethyl-2,4-dioxo-1,2,3,4-tetrahydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)acetamide [ACD/IUPAC Name]
N-{[1-(3-Chlorobenzyl)-4-pipéridinyl]méthyl}-2-(1,3-diéthyl-2,4-dioxo-1,2,3,4-tétrahydro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)acétamide [French] [ACD/IUPAC Name]
N-[2-(diethylamino)ethyl]-4-methoxy-N-[2-(piperazin-1-ylsulfonyl)ethyl]benzenesulfonamide

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: 1.644
Molar Refractivity: 133.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 0.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.40
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 19.74
ACD/KOC (pH 7.4): 169.03
Polar Surface Area: 78 Å2
Polarizability: 52.8±0.5 10-24cm3
Surface Tension: 51.9±7.0 dyne/cm
Molar Volume: 367.9±7.0 cm3

Click to predict properties on the Chemicalize site


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