ChemSpider 2D Image | MUTAPRODENAFIL | C27H35N9O5S2

MUTAPRODENAFIL

  • Molecular FormulaC27H35N9O5S2
  • Average mass629.754 Da
  • Monoisotopic mass629.220276 Da
  • ChemSpider ID64880448

More details:

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

1H-Pyrazolo[4,3-d]pyrimidine, 5-[5-[(3,5-dimethyl-1-piperazinyl)sulfonyl]-2-ethoxyphenyl]-1-methyl-7-[(1-methyl-4-nitro-1H-imidazol-5-yl)thio]-3-propyl- [ACD/Index Name]
5-{5-[(3,5-Dimethyl-1-piperazinyl)sulfonyl]-2-ethoxyphenyl}-1-methyl-7-[(1-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-3-propyl-1H-pyrazolo[4,3-d]pyrimidin [German] [ACD/IUPAC Name]
5-{5-[(3,5-Dimethyl-1-piperazinyl)sulfonyl]-2-ethoxyphenyl}-1-methyl-7-[(1-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-3-propyl-1H-pyrazolo[4,3-d]pyrimidine [ACD/IUPAC Name]
5-{5-[(3,5-Diméthyl-1-pipérazinyl)sulfonyl]-2-éthoxyphényl}-1-méthyl-7-[(1-méthyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-3-propyl-1H-pyrazolo[4,3-d]pyrimidine [French] [ACD/IUPAC Name]
MUTAPRODENAFIL
1387577-30-1 [RN]

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

0KBR3VF526 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 765.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.4±3.0 kJ/mol
Flash Point: 416.4±35.7 °C
Index of Refraction: 1.712
Molar Refractivity: 164.9±0.5 cm3
#H bond acceptors: 14
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 4.66
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 1.19
ACD/KOC (pH 5.5): 8.87
ACD/LogD (pH 7.4): 2.82
ACD/BCF (pH 7.4): 59.68
ACD/KOC (pH 7.4): 444.36
Polar Surface Area: 200 Å2
Polarizability: 65.4±0.5 10-24cm3
Surface Tension: 60.5±7.0 dyne/cm
Molar Volume: 421.1±7.0 cm3

Click to predict properties on the Chemicalize site


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