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Chemical structure of TBTDC

GC70916

TBTDC

Also known as 3-methyl-5-[(E)-[5-[7-[4-(N-phenylanilino)phenyl]-2,1,3-benzothiadiazol-4-yl]thiophen-2-yl]methylideneamino]thiophene-2,4-dicarbonitrile

TBTDC is a highly efficient multifunctional organic photosensitizer with aggregation-induced emission for in vivo bioimaging and photodynamic research

ChemicalCAS2866214-44-8MW634.8FormulaC36H22N6S3
CAS number
2866214-44-8
Molecular weight
634.8
Formula
C36H22N6S3
Solubility
Dichloromethane ： 0·56 mg/mL (0·88 mM; ultrasonic and warming and heat to 60°C)
InChIKey
KJLSQPPZBSVZJS-WVKHYPTHSA-N
Catalogue number
GC70916
Brand
GLPBIO
Computed properties PubChem CID 162679300 · XLogP 9.8 · TPSA 174 Ų · H-bond donors 0
XLogP
9.8
TPSA
174 Ų
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
45

SMILES CC1=C(SC(=C1C#N)/N=C/C2=CC=C(S2)C3=CC=C(C4=NSN=C34)C5=CC=C(C=C5)N(C6=CC=CC=C6)C7=CC=CC=C7)C#N

Computed descriptors from PubChem (CID 162679300), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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