ChemSpider 2D Image | N-(Cyclohexylcarbamoyl)-2-[(8-isobutyl-2,6-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]propanamide | C22H32N6O4S

N-(Cyclohexylcarbamoyl)-2-[(8-isobutyl-2,6-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]propanamide

  • Molecular FormulaC22H32N6O4S
  • Average mass476.592 Da
  • Monoisotopic mass476.220581 Da
  • ChemSpider ID22358895

More details:

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

N-(Cyclohexylcarbamoyl)-2-[(8-isobutyl-2,6-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]propanamid [German] [ACD/IUPAC Name]
N-(Cyclohexylcarbamoyl)-2-[(8-isobutyl-2,6-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]propanamide [ACD/IUPAC Name]
N-(Cyclohexylcarbamoyl)-2-[(8-isobutyl-2,6-diméthyl-5,7-dioxo-5,6,7,8-tétrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]propanamide [French] [ACD/IUPAC Name]
Propanamide, N-[(cyclohexylamino)carbonyl]-2-[[5,6,7,8-tetrahydro-2,6-dimethyl-8-(2-methylpropyl)-5,7-dioxopyrimido[4,5-d]pyrimidin-4-yl]thio]- [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: 1.608
Molar Refractivity: 125.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 3.19
ACD/BCF (pH 5.5): 157.55
ACD/KOC (pH 5.5): 1301.16
ACD/LogD (pH 7.4): 3.19
ACD/BCF (pH 7.4): 155.86
ACD/KOC (pH 7.4): 1287.20
Polar Surface Area: 150 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 65.2±5.0 dyne/cm
Molar Volume: 361.7±5.0 cm3

Click to predict properties on the Chemicalize site


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