ChemSpider 2D Image | 3-(4-Chlorophenyl)-1-{1-[(2-ethoxyphenyl)amino]-1-oxo-2-butanyl}-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide | C28H29ClN4O5S

3-(4-Chlorophenyl)-1-{1-[(2-ethoxyphenyl)amino]-1-oxo-2-butanyl}-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide

  • Molecular FormulaC28H29ClN4O5S
  • Average mass569.072 Da
  • Monoisotopic mass568.154724 Da
  • ChemSpider ID3339604

More details:

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

3-(4-Chlorophenyl)-1-{1-[(2-ethoxyphenyl)amino]-1-oxo-2-butanyl}-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide [ACD/IUPAC Name]
3-(4-Chlorophényl)-1-{1-[(2-éthoxyphényl)amino]-1-oxo-2-butanyl}-N,N,5-triméthyl-2,4-dioxo-1,2,3,4-tétrahydrothiéno[2,3-d]pyrimidine-6-carboxamide [French] [ACD/IUPAC Name]
3-(4-Chlorphenyl)-1-{1-[(2-ethoxyphenyl)amino]-1-oxo-2-butanyl}-N,N,5-trimethyl-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidin-6-carboxamid [German] [ACD/IUPAC Name]
Thieno[2,3-d]pyrimidine-1(2H)-acetamide, 3-(4-chlorophenyl)-6-[(dimethylamino)carbonyl]-N-(2-ethoxyphenyl)-α-ethyl-3,4-dihydro-5-methyl-2,4-dioxo- [ACD/Index Name]

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: 1.642
Molar Refractivity: 151.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 3.89
ACD/BCF (pH 5.5): 530.31
ACD/KOC (pH 5.5): 3103.21
ACD/LogD (pH 7.4): 3.89
ACD/BCF (pH 7.4): 530.37
ACD/KOC (pH 7.4): 3103.52
Polar Surface Area: 128 Å2
Polarizability: 59.9±0.5 10-24cm3
Surface Tension: 59.7±3.0 dyne/cm
Molar Volume: 418.7±3.0 cm3

Click to predict properties on the Chemicalize site


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