9H-Carbazole, 9-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)[1,1':3',1''-terphenyl]-2'-yl]-3,6-diphenyl-

HCID 178958597CAS 2329651-89-8
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Basic information

Standard SMILES
c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2c(-c3ccccc3)cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2-c2ccccc2)cc1
InChIKey
MTSZLTRICWZBQA-UHFFFAOYSA-N
Molecular formula
C57H38N4
Average molar mass
778.9 g/mol

Names & identifiers

Preferred name
9H-Carbazole, 9-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)[1,1':3',1''-terphenyl]-2'-yl]-3,6-diphenyl-
IUPAC
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]-3,6-diphenylcarbazole
English name
9H-Carbazole, 9-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)[1,1':3',1''-terphenyl]-2'-yl]-3,6-diphenyl-
Molecular formula
C57H38N4
Molecular weight
778.94

Names & synonyms

2329651-89-89H-Carbazole, 9-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)[1,1':3',1''-terphenyl]-2'-yl]-3,6-diphenyl-9-(5'-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1,1':3',1''-terphenyl]-2'-yl)-3,6-diphenyl-9h-carbazoleSCHEMBL21022449SCHEMBL30570931G809420.999PPCzTrz9-[5'-(4,6-diphenyl-1,3,5-triazin-2-yl)[1,1':3',1''-terphenyl]-2'-yl]-3,6-diphenyl-9H-Carbazole9-(5'-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1,1':3',1''-terbenzene]-2'-yl)-3,6-diphenyl-9H-carbazole

Database identifiers

CAS
2329651-89-8

Properties

Computed structural properties

XLogP
14.5
Topological polar surface area
43.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
8
Heavy atoms
61

Physicochemical properties

Density
1.18 · 1.18±0.1 g/cm3(Predicted)
pka
0.59 · 0.59±0.10(Predicted)
InChIKey
MTSZLTRICWZBQA-UHFFFAOYSA-N
SMILES
N1(C2=C(C3=CC=CC=C3)C=C(C3=NC(C4=CC=CC=C4)=NC(C4=CC=CC=C4)=N3)C=C2C2=CC=CC=C2)C2=C(C=C(C3=CC=CC=C3)C=C2)C2=C1C=CC(C1=CC=CC=C1)=C2

Chemistry & industry

Suppliers18 total

武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
Shanghai Medfine Bio-pharmaceutical Co., Ltd+86-86-13013810076 +86-13013810076 · [email protected]
深圳睿迅光电材料科技有限公司0755-26718755; 15889762949 · [email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
NANJING YINGWEN BIOTECHNOLOGY CO LTD+86-13382787392 · [email protected]

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