ChemSpider 2D Image | THIOHOMOSILDENAFIL | C23H32N6O3S2

THIOHOMOSILDENAFIL

  • Molecular FormulaC23H32N6O3S2
  • Average mass504.669 Da
  • Monoisotopic mass504.197723 Da
  • ChemSpider ID8382953

More details:






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

479073-80-8 [RN]
5-{2-Ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl}-1-methyl-3-propyl-1,4-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-thion [German] [ACD/IUPAC Name]
5-{2-Ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl}-1-methyl-3-propyl-1,4-dihydro-7H-pyrazolo[4,3-d]pyrimidine-7-thione [ACD/IUPAC Name]
5-{2-Éthoxy-5-[(4-éthyl-1-pipérazinyl)sulfonyl]phényl}-1-méthyl-3-propyl-1,4-dihydro-7H-pyrazolo[4,3-d]pyrimidine-7-thione [French] [ACD/IUPAC Name]
7H-Pyrazolo[4,3-d]pyrimidine-7-thione, 5-[2-ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-1,4-dihydro-1-methyl-3-propyl- [ACD/Index Name]
Thiohomo Sildenafil
THIOHOMOSILDENAFIL
1-[[3-(4,7-Dihydro-1-methyl-3-propyl-7-thioxo-1H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxyphenyl]sulfonyl]-4-ethyl-piperazine
5-(2-Ethoxy-5-((4-ethylpiperazin-1-yl)sulfonyl)phenyl)-1-methyl-3-propyl-1H-pyrazolo[4,3-d]pyrimidine-7(6H)-thione
5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylphenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

80L868CDW0 [DBID]
UNII:80L868CDW0 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 683.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.2±3.0 kJ/mol
Flash Point: 367.1±34.3 °C
Index of Refraction: 1.670
Molar Refractivity: 137.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 1.52
ACD/BCF (pH 5.5): 3.39
ACD/KOC (pH 5.5): 28.56
ACD/LogD (pH 7.4): 2.96
ACD/BCF (pH 7.4): 94.46
ACD/KOC (pH 7.4): 796.88
Polar Surface Area: 133 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 51.7±7.0 dyne/cm
Molar Volume: 366.9±7.0 cm3

Click to predict properties on the Chemicalize site






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