ChemSpider 2D Image | N-(6-(4-(2H-tetrazol-5-yl)benzyl)-3-cyano-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2,4-dichloro-5-(morpholinosulfonyl)benzamide | C27H24Cl2N8O4S2

N-(6-(4-(2H-tetrazol-5-yl)benzyl)-3-cyano-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2,4-dichloro-5-(morpholinosulfonyl)benzamide

  • Molecular FormulaC27H24Cl2N8O4S2
  • Average mass659.567 Da
  • Monoisotopic mass658.073914 Da
  • ChemSpider ID30819918

More details:

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

2,4-Dichlor-N-{3-cyan-6-[4-(1H-tetrazol-5-yl)benzyl]-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl}-5-(4-morpholinylsulfonyl)benzamid [German] [ACD/IUPAC Name]
2,4-Dichloro-N-{3-cyano-6-[4-(1H-tetrazol-5-yl)benzyl]-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl}-5-(4-morpholinylsulfonyl)benzamide [ACD/IUPAC Name]
2,4-Dichloro-N-{3-cyano-6-[4-(1H-tétrazol-5-yl)benzyl]-4,5,6,7-tétrahydrothiéno[2,3-c]pyridin-2-yl}-5-(4-morpholinylsulfonyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 2,4-dichloro-N-[3-cyano-4,5,6,7-tetrahydro-6-[[4-(1H-tetrazol-5-yl)phenyl]methyl]thieno[2,3-c]pyridin-2-yl]-5-(4-morpholinylsulfonyl)- [ACD/Index Name]
N-(6-(4-(2H-tetrazol-5-yl)benzyl)-3-cyano-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2,4-dichloro-5-(morpholinosulfonyl)benzamide

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.742
Molar Refractivity: 160.2±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 3.15
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 2.73
ACD/KOC (pH 5.5): 22.53
ACD/LogD (pH 7.4): 1.21
ACD/BCF (pH 7.4): 1.63
ACD/KOC (pH 7.4): 13.49
Polar Surface Area: 194 Å2
Polarizability: 63.5±0.5 10-24cm3
Surface Tension: 102.0±5.0 dyne/cm
Molar Volume: 396.6±5.0 cm3

Click to predict properties on the Chemicalize site


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