Found 164 results

Search term: MF = 'C_{30}H_{33}N_{5}O_{5}S'
ChemSpider 2D Image | N-[(3S,4S)-4-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl]-2-methyl-5-{3-(2-methyl-2-propanyl)-5-[(1-naphthylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamide | C30H33N5O5S

N-[(3S,4S)-4-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl]-2-methyl-5-{3-(2-methyl-2-propanyl)-5-[(1-naphthylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamide

  • Molecular FormulaC30H33N5O5S
  • Average mass575.679 Da
  • Monoisotopic mass575.220215 Da
  • ChemSpider ID26365653

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Benzamide, 5-[3-(1,1-dimethylethyl)-5-[[(1-naphthalenylamino)carbonyl]amino]-1H-pyrazol-1-yl]-2-methyl-N-[(3S,4S)-tetrahydro-4-hydroxy-1,1-dioxido-3-thienyl]- [ACD/Index Name]
N-[(3S,4S)-4-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl]-2-methyl-5-{3-(2-methyl-2-propanyl)-5-[(1-naphthylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamid [German] [ACD/IUPAC Name]
N-[(3S,4S)-4-Hydroxy-1,1-dioxidotetrahydro-3-thiophenyl]-2-methyl-5-{3-(2-methyl-2-propanyl)-5-[(1-naphthylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamide [ACD/IUPAC Name]
N-[(3S,4S)-4-Hydroxy-1,1-dioxydotétrahydro-3-thiophényl]-2-méthyl-5-{3-(2-méthyl-2-propanyl)-5-[(1-naphtylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamide [French] [ACD/IUPAC 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: 746.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.1±3.0 kJ/mol
Flash Point: 404.9±32.9 °C
Index of Refraction: 1.676
Molar Refractivity: 156.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 160.07
ACD/KOC (pH 5.5): 1316.51
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 160.08
ACD/KOC (pH 7.4): 1316.67
Polar Surface Area: 151 Å2
Polarizability: 62.0±0.5 10-24cm3
Surface Tension: 55.5±7.0 dyne/cm
Molar Volume: 415.7±7.0 cm3

Click to predict properties on the Chemicalize site


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