Found 1 result

Search term: NJHCKBMHHOFFFF (Found by InChIKey (skeleton match))
ChemSpider 2D Image | S-(1,3-Dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-6-yl) dimethylcarbamothioate | C12H14N4O3S

S-(1,3-Dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-6-yl) dimethylcarbamothioate

  • Molecular FormulaC12H14N4O3S
  • Average mass294.330 Da
  • Monoisotopic mass294.078674 Da
  • ChemSpider ID25992085

More details:

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

1-({1,3-dimethyl-2,4-dioxo-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-6-yl}sulfanyl)-N,N-dimethylformamide
1235441-05-0 [RN]
Carbamothioic acid, N,N-dimethyl-, S-(1,2,3,4-tetrahydro-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-6-yl) ester [ACD/Index Name]
Diméthylcarbamothioate de S-(1,3-diméthyl-2,4-dioxo-1,2,3,4-tétrahydropyrido[2,3-d]pyrimidin-6-yle) [French] [ACD/IUPAC Name]
S-(1,3-Dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-6-yl) dimethylcarbamothioate [ACD/IUPAC Name]
S-(1,3-Dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-6-yl)-dimethylcarbamothioat [German] [ACD/IUPAC Name]
1-((1,3-DIMETHYL-2,4-DIOXO-1H,2H,3H,4H-PYRIDO[2,3-D]PYRIMIDIN-6-YL)SULFANYL)-N,N-DIMETHYLFORMAMIDE
MFCD16040112 [MDL number]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 481.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.7±3.0 kJ/mol
Flash Point: 245.2±31.5 °C
Index of Refraction: 1.660
Molar Refractivity: 74.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.11
ACD/LogD (pH 5.5): 0.41
ACD/BCF (pH 5.5): 1.21
ACD/KOC (pH 5.5): 39.88
ACD/LogD (pH 7.4): 0.41
ACD/BCF (pH 7.4): 1.21
ACD/KOC (pH 7.4): 39.88
Polar Surface Area: 99 Å2
Polarizability: 29.7±0.5 10-24cm3
Surface Tension: 73.3±5.0 dyne/cm
Molar Volume: 202.8±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement