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[ CAS No. 25440-14-6 ] 5,10,15,20-Tetrakis(pentafluorophenyl)-21h,23h-porphine

Cat. No.: A543645
Chemical Structure| 25440-14-6
Chemical Structure| 25440-14-6
Structure of 25440-14-6 * Storage: Keep in dark place,Sealed in dry,Room Temperature
Purity Size Price USA Stock *0-1 Day Global Stock *5-7 Days Quantity
98% 100mg $62.00 Inquiry Inquiry
98% 250mg $106.00 Inquiry Inquiry
98% 1g $297.00 Inquiry Inquiry
98% 5g $824.00 Inquiry Inquiry

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* Storage: Keep in dark place,Sealed in dry,Room Temperature

* Shipping: Normal

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Product Details of [ 25440-14-6 ]

CAS No. :25440-14-6 MDL No. :MFCD00010032
Formula : C44H10F20N4 Boiling Point : -
Linear Structure Formula :- InChI Key :VJEVAXUMNMFKDT-UHFFFAOYSA-N
M.W : 974.55 Pubchem ID :135401562
Synonyms :

Calculated chemistry of [ 25440-14-6 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 68
Num. arom. heavy atoms : 34
Fraction Csp3 : 0.0
Num. rotatable bonds : 4
Num. H-bond acceptors : 22.0
Num. H-bond donors : 2.0
Molar Refractivity : 202.63
TPSA : 56.3 Ų

Pharmacokinetics

GI absorption : Low
BBB permeant : No
P-gp substrate : Yes
CYP1A2 inhibitor : No
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -3.43 cm/s

Lipophilicity

Log Po/w (iLOGP) : 5.13
Log Po/w (XLOGP3) : 12.42
Log Po/w (WLOGP) : 18.42
Log Po/w (MLOGP) : 11.92
Log Po/w (SILICOS-IT) : 18.67
Consensus Log Po/w : 13.31

Druglikeness

Lipinski : 2.0
Ghose : None
Veber : 0.0
Egan : 1.0
Muegge : 4.0
Bioavailability Score : 0.17

Water Solubility

Log S (ESOL) : -13.81
Solubility : 0.0 mg/ml ; 0.0 mol/l
Class : Insoluble
Log S (Ali) : -13.62
Solubility : 0.0 mg/ml ; 0.0 mol/l
Class : Insoluble
Log S (SILICOS-IT) : -20.46
Solubility : 3.38e-18 mg/ml ; 3.47e-21 mol/l
Class : Insoluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 2.0 alert
Leadlikeness : 2.0
Synthetic accessibility : 7.47

Safety of [ 25440-14-6 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P261-P305+P351+P338 UN#:N/A
Hazard Statements:H315-H319-H335 Packing Group:N/A
GHS Pictogram:
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