ChemSpider 2D Image | N-{(R)-Cyclopropyl[3-(cyclopropylmethoxy)-4-fluorophenyl]methyl}-3-[(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methoxy]-1-propanesulfonamide | C22H28FN3O6S

N-{(R)-Cyclopropyl[3-(cyclopropylmethoxy)-4-fluorophenyl]methyl}-3-[(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methoxy]-1-propanesulfonamide

  • Molecular FormulaC22H28FN3O6S
  • Average mass481.538 Da
  • Monoisotopic mass481.168274 Da
  • ChemSpider ID34953374

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-Propanesulfonamide, N-[(R)-cyclopropyl[3-(cyclopropylmethoxy)-4-fluorophenyl]methyl]-3-[(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)methoxy]- [ACD/Index Name]
N-{(R)-Cyclopropyl[3-(cyclopropylmethoxy)-4-fluorophenyl]methyl}-3-[(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methoxy]-1-propanesulfonamide [ACD/IUPAC Name]
N-{(R)-Cyclopropyl[3-(cyclopropylméthoxy)-4-fluorophényl]méthyl}-3-[(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)méthoxy]-1-propanesulfonamide [French] [ACD/IUPAC Name]
N-{(R)-Cyclopropyl[3-(cyclopropylmethoxy)-4-fluorphenyl]methyl}-3-[(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methoxy]-1-propansulfonamid [German] [ACD/IUPAC Name]
US8530490, 40

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.596
Molar Refractivity: 118.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 8.83
ACD/KOC (pH 5.5): 165.41
ACD/LogD (pH 7.4): 1.54
ACD/BCF (pH 7.4): 8.69
ACD/KOC (pH 7.4): 162.82
Polar Surface Area: 122 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 57.3±3.0 dyne/cm
Molar Volume: 347.9±3.0 cm3

Click to predict properties on the Chemicalize site


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