Silicon Phthalocyanine 4

CAT: 0931-T28777Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0931-T28777Size:25 mg

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CAS Number

135719-28-7

Target

Others, Parasite

Related Pathways

Others, Microbiology/Virology

Bioactivity

Silicon Phthalocyanine 4 is a drug with anti-cutaneous neoplasms activity.

Smiles

[O-]([Si](CCCN(C)C)(C)C)[Si+4]123([OH-])[N-]4C=5C=6C(C4=NC7=[N]1C(=NC=8[N-]2C(=C9C8C=CC=C9)N=C%10[N]3=C(N5)C=%11C%10=CC=CC%11)C=%12C7=CC=CC%12)=CC=CC6

Molecular Formula

C39H35N9O2Si2

Molecular Weight

717.93

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Silicon phthalocyanine

Silicon Phthalocyanine 4 is a synthetic photosensitizer agent containing a large macrocyclic ring chelated with silicon. Silicon phthalocyanine 4 localizes primarily in mitochondrial cytosolic membranes and, after photoexcitation, forms reactive oxygen species that induce apoptosis.

CAS Number	135719-28-7
PubChem CID	119185
IUPAC Name	3-[dimethyl(oxido)silyl]-N,N-dimethylpropan-1-amine;2,11,20,37,38-pentaza-39,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19,21(38),22,24,26,28,30(37),31,33,35-nonadecaene;silicon(4+);hydroxide
Molecular Formula	C40H36N8O2Si2
Molecular Weight	716.9
Topological Polar Surface Area	93.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	4
Heavy Atom Count	52
Formal Charge	0
Complexity	939

SMILES

CN(C)CCC[Si](C)(C)[O-].C1=CC=C2C(=C1)C3=CC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=NC2=N3)[N-]7)C9=CC=CC=C94.[OH-].[Si+4]

InChI

InChI=1S/C33H17N7.C7H18NOSi.H2O.Si/c1-3-11-20-18(9-1)26-17-27-19-10-2-4-12-21(19)29(35-27)37-31-23-14-6-8-16-25(23)33(39-31)40-32-24-15-7-5-13-22(24)30(38-32)36-28(20)34-26;1-8(2)6-5-7-10(3,4)9;;/h1-17H;5-7H2,1-4H3;1H2;/q-2;-1;;+4/p-1

InChIKey

JACPFCQFVIAGDN-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 135719-28-7

CID: 119185

Formula: C40H36N8O2Si2

MW: 716.9

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	716.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	4
Exact Mass	716.24997549
Monoisotopic Mass	716.24997549
Topological Polar Surface Area	93.8 Å²
Heavy Atom Count	52
Formal Charge	0
Complexity	939
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	4
Compound Is Canonicalized	Yes

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CB0265M	Soil available silicon Assay Kit (Microanalysis)

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MBS5778448	Silicon Phthalocyanine 4
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FP62479-01	Phthalocyanine Silicon Dichloride
HY-121310-01	Phthalocyanine
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MBS3845527-01	Cobalt phthalocyanine
OR1012645-01	Chloroaluminum Phthalocyanine
90026998	Iron phthalocyanine
S06870-01	Sodium phthalocyanine

Silicon Phthalocyanine 4

Chemical Information

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