ChemSpider 2D Image | Temoporfin | C44H32N4O4

Temoporfin

  • Molecular FormulaC44H32N4O4
  • Average mass680.749 Da
  • Monoisotopic mass680.242371 Da
  • ChemSpider ID54754
  • Double-bond stereo - Double-bond stereo


More details:



Featured data source



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

122341-38-2 [RN]
3,3',3'',3'''-(2,3-Dihydroporphyrin-5,10,15,20-tetrayl)tetraphenol [ACD/IUPAC Name]
3,3',3'',3'''-(2,3-Dihydroporphyrin-5,10,15,20-tetrayl)tetraphenol [German] [ACD/IUPAC Name]
3,3',3'',3'''-(2,3-Dihydroporphyrine-5,10,15,20-tétrayl)tetraphénol [French] [ACD/IUPAC Name]
5,10,15,20-Tetra(m-hydroxyphenyl)chlorin
5,10,15,20-Tetrakis(m-hydroxyphenyl)chlorin
Dihydro meta-HK7
ef 9
mTHPC
m-THPC
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

C11730 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Bio Activity:

      Others MedChem Express HY-16488
      Temoporfin(KW 2345) used in photodynamic therapy for the treatment of squamous cell carcinoma of the head and neck. MedChem Express
      Temoporfin(KW 2345) used in photodynamic therapy for the treatment of squamous cell carcinoma of the head and neck.; Target: Others; Temoporfin used in photodynamic therapy for the treatment of squamous cell carcinoma of the head and neck. MedChem Express HY-16488
      Temoporfin(KW 2345) used in photodynamic therapy for the treatment of squamous cell carcinoma of the head and neck.;Target: ;Temoporfin used in photodynamic therapy for the treatment of squamous cell carcinoma of the head and neck. Patients can remain photosensitive for several weeks after treatment. MedChem Express HY-16488

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.735
Molar Refractivity: 196.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 9.17
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 138 Å2
Polarizability: 78.0±0.5 10-24cm3
Surface Tension: 73.3±3.0 dyne/cm
Molar Volume: 490.8±3.0 cm3

Click to predict properties on the Chemicalize site





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