ChemSpider 2D Image | N-(4-Chlorophenyl)-2-[(4-oxo-5-{[4-(1-pyrrolidinyl)phenyl]sulfonyl}-1,4-dihydro-2-pyrimidinyl)sulfanyl]acetamide | C22H21ClN4O4S2

N-(4-Chlorophenyl)-2-[(4-oxo-5-{[4-(1-pyrrolidinyl)phenyl]sulfonyl}-1,4-dihydro-2-pyrimidinyl)sulfanyl]acetamide

  • Molecular FormulaC22H21ClN4O4S2
  • Average mass505.009 Da
  • Monoisotopic mass504.069275 Da
  • ChemSpider ID28947654

More details:

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

Acetamide, N-(4-chlorophenyl)-2-[[1,6-dihydro-6-oxo-5-[[4-(1-pyrrolidinyl)phenyl]sulfonyl]-2-pyrimidinyl]thio]- [ACD/Index Name]
N-(4-Chlorophenyl)-2-[(4-oxo-5-{[4-(1-pyrrolidinyl)phenyl]sulfonyl}-1,4-dihydro-2-pyrimidinyl)sulfanyl]acetamide [ACD/IUPAC Name]
N-(4-Chlorophényl)-2-[(4-oxo-5-{[4-(1-pyrrolidinyl)phényl]sulfonyl}-1,4-dihydro-2-pyrimidinyl)sulfanyl]acétamide [French] [ACD/IUPAC Name]
N-(4-Chlorphenyl)-2-[(4-oxo-5-{[4-(1-pyrrolidinyl)phenyl]sulfonyl}-1,4-dihydro-2-pyrimidinyl)sulfanyl]acetamid [German] [ACD/IUPAC Name]
1223977-88-5 [RN]
N-(4-chlorophenyl)-2-((6-oxo-5-((4-(pyrrolidin-1-yl)phenyl)sulfonyl)-1,6-dihydropyrimidin-2-yl)thio)acetamide
N-(4-CHLOROPHENYL)-2-({4-OXO-5-[4-(PYRROLIDIN-1-YL)BENZENESULFONYL]-3H-PYRIMIDIN-2-YL}SULFANYL)ACETAMIDE
N-(4-chlorophenyl)-2-[[6-oxo-5-(4-pyrrolidin-1-ylphenyl)sulfonyl-1H-pyrimidin-2-yl]sulfanyl]acetamide

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: 1.706
Molar Refractivity: 130.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.13
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 10.77
ACD/KOC (pH 5.5): 132.74
ACD/LogD (pH 7.4): 0.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.95
Polar Surface Area: 142 Å2
Polarizability: 51.8±0.5 10-24cm3
Surface Tension: 63.6±7.0 dyne/cm
Molar Volume: 335.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement