Found 55 results

Search term: MF = 'C_{25}H_{24}N_{2}O_{3}S_{3}'
ChemSpider 2D Image | N-[(6S)-3-(1,3-Benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(benzylsulfonyl)acetamide | C25H24N2O3S3

N-[(6S)-3-(1,3-Benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(benzylsulfonyl)acetamide

  • Molecular FormulaC25H24N2O3S3
  • Average mass496.665 Da
  • Monoisotopic mass496.094910 Da
  • ChemSpider ID62463694

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Acetamide, N-[(6S)-3-(2-benzothiazolyl)-4,5,6,7-tetrahydro-6-methylbenzo[b]thien-2-yl]-2-[(phenylmethyl)sulfonyl]- [ACD/Index Name]
N-[(6S)-3-(1,3-Benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(benzylsulfonyl)acetamid [German] [ACD/IUPAC Name]
N-[(6S)-3-(1,3-Benzothiazol-2-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(benzylsulfonyl)acetamide [ACD/IUPAC Name]
N-[(6S)-3-(1,3-Benzothiazol-2-yl)-6-méthyl-4,5,6,7-tétrahydro-1-benzothiophén-2-yl]-2-(benzylsulfonyl)acétamide [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.678
Molar Refractivity: 135.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.55
ACD/LogD (pH 5.5): 5.26
ACD/BCF (pH 5.5): 5866.17
ACD/KOC (pH 5.5): 17337.20
ACD/LogD (pH 7.4): 5.26
ACD/BCF (pH 7.4): 5865.80
ACD/KOC (pH 7.4): 17336.11
Polar Surface Area: 141 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 62.4±3.0 dyne/cm
Molar Volume: 359.2±3.0 cm3

Click to predict properties on the Chemicalize site


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