2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole

C71H46N6S — CID 88878728

IUPAC2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole
SMILESCc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc(C)c1-n1c2cc(-c3ccc4sc5ccc(-n6c7ccccc7c7ccccc76)cc5c4c3)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21
InChIInChI=1S/C71H46N6S/c1-43-37-49(71-73-69(45-17-5-3-6-18-45)72-70(74-71)46-19-7-4-8-20-46)38-44(2)68(43)77-64-40-48(29-33-56(64)57-34-31-51(42-65(57)77)76-62-27-15-11-23-54(62)55-24-12-16-28-63(55)76)47-30-35-66-58(39-47)59-41-50(32-36-67(59)78-66)75-60-25-13-9-21-52(60)53-22-10-14-26-61(53)75/h3-42H,1-2H3
InChIKeyDOZORJIMUYGVKQ-UHFFFAOYSA-N
MW1015.26 g/mol
LogP18.82
Rot. Bonds7

About 2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole

2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole (PubChem CID 88878728) has the molecular formula C71H46N6S and a molecular weight of 1015.26 g/mol. Its IUPAC name is 2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole.

Molecular Properties

Compound Name2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole
PubChem CID88878728
Molecular FormulaC71H46N6S
Molecular Weight1015.26 g/mol
Exact Mass1014.35
IUPAC Name2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole
SMILESCc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc(C)c1-n1c2cc(-c3ccc4sc5ccc(-n6c7ccccc7c7ccccc76)cc5c4c3)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21
InChIInChI=1S/C71H46N6S/c1-43-37-49(71-73-69(45-17-5-3-6-18-45)72-70(74-71)46-19-7-4-8-20-46)38-44(2)68(43)77-64-40-48(29-33-56(64)57-34-31-51(42-65(57)77)76-62-27-15-11-23-54(62)55-24-12-16-28-63(55)76)47-30-35-66-58(39-47)59-41-50(32-36-67(59)78-66)75-60-25-13-9-21-52(60)53-22-10-14-26-61(53)75/h3-42H,1-2H3
InChIKeyDOZORJIMUYGVKQ-UHFFFAOYSA-N
XLogP18.82
TPSA53.46 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms78
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001015.26
LogP ≤ 518.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-carbazol-9-yl-9-[4-(4-dibenzothiophen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylcarbazole
CID 146179575
3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 90211472
3-dibenzothiophen-2-yl-9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole
CID 90211436
9-(4-dibenzothiophen-2-ylphenyl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 171438054
9-[7-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]dibenzothiophen-3-yl]carbazole
CID 169011175
9-[17-(4,6-diphenyl-1,3,5-triazin-2-yl)-10,20-dithiapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-6-yl]carbazole
CID 146664265
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole
CID 118518202
9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-3-(10,20-dithiapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)carbazole;9-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-(10,20-dithiapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)carbazole;9-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-(10,20-dithiapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-6-yl)carbazole
CID 157308246
3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(2,4,6-trimethylphenyl)carbazole
CID 71232544
9-(4-dibenzothiophen-2-ylphenyl)-3-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 171438044
3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-[9-(2,4,6-trimethylphenyl)carbazol-3-yl]carbazole
CID 71232829
9-[8-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]dibenzothiophen-3-yl]carbazole
CID 169011633

Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole?
The IUPAC name of 2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole (CID 88878728) is 2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole.
What is the SMILES notation for 2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole?
The canonical SMILES for 2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole is Cc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc(C)c1-n1c2cc(-c3ccc4sc5ccc(-n6c7ccccc7c7ccccc76)cc5c4c3)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21.
What is the InChIKey of 2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole?
The InChIKey is DOZORJIMUYGVKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H46N6S/c1-43-37-49(71-73-69(45-17-5-3-6-18-45)72-70(74-71)46-19-7-4-8-20-46)38-44(2)68(43)77-64-40-48(29-33-56(64)57-34-31-51(42-65(57)77)76-62-27-15-11-23-54(62)55-24-12-16-28-63(55)76)47-30-35-66-58(39-47)59-41-50(32-36-67(59)78-66)75-60-25-13-9-21-52(60)53-22-10-14-26-61(53)75/h3-42H,1-2H3.
What are the key properties of 2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole?
2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole has a molecular weight of 1015.26 g/mol, XLogP of 18.82, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-carbazol-9-yl-7-(8-carbazol-9-yldibenzothiophen-2-yl)-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-dimethylphenyl]carbazole is sourced from PubChem (CID 88878728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).