3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole

C75H51N5 — CID 167403511

IUPAC3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole
SMILESC1=CC(c2ccccc2)CC=C1c1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc(-c2ccc(-c3ccccc3)cc2)c1-n1c2ccc(-c3ccccc3)cc2c2cc(-n3c4ccccc4c4ccccc43)ccc21
InChIInChI=1S/C75H51N5/c1-6-20-50(21-7-1)53-34-38-55(39-35-53)64-47-60(75-77-73(57-26-12-4-13-27-57)76-74(78-75)58-28-14-5-15-29-58)48-65(56-40-36-54(37-41-56)51-22-8-2-9-23-51)72(64)80-70-44-42-59(52-24-10-3-11-25-52)46-66(70)67-49-61(43-45-71(67)80)79-68-32-18-16-30-62(68)63-31-17-19-33-69(63)79/h1-36,38-49,54H,37H2
InChIKeyWMADSKWZFUNZJN-UHFFFAOYSA-N
MW1022.27 g/mol
LogP19.19
Rot. Bonds10

About 3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole

3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole (PubChem CID 167403511) has the molecular formula C75H51N5 and a molecular weight of 1022.27 g/mol. Its IUPAC name is 3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole.

Molecular Properties

Compound Name3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole
PubChem CID167403511
Molecular FormulaC75H51N5
Molecular Weight1022.27 g/mol
Exact Mass1021.41
IUPAC Name3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole
SMILESC1=CC(c2ccccc2)CC=C1c1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc(-c2ccc(-c3ccccc3)cc2)c1-n1c2ccc(-c3ccccc3)cc2c2cc(-n3c4ccccc4c4ccccc43)ccc21
InChIInChI=1S/C75H51N5/c1-6-20-50(21-7-1)53-34-38-55(39-35-53)64-47-60(75-77-73(57-26-12-4-13-27-57)76-74(78-75)58-28-14-5-15-29-58)48-65(56-40-36-54(37-41-56)51-22-8-2-9-23-51)72(64)80-70-44-42-59(52-24-10-3-11-25-52)46-66(70)67-49-61(43-45-71(67)80)79-68-32-18-16-30-62(68)63-31-17-19-33-69(63)79/h1-36,38-49,54H,37H2
InChIKeyWMADSKWZFUNZJN-UHFFFAOYSA-N
XLogP19.19
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms80
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001022.27
LogP ≤ 519.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole 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

9-[2-(4-cyclohexa-2,4-dien-1-ylphenyl)-4-[4-[(1S)-cyclohexa-2,4-dien-1-yl]-6-phenyl-1,3,5-triazin-2-yl]-6-[(4R)-4-phenylcyclohexa-1,5-dien-1-yl]phenyl]-3,6-diphenylcarbazole
CID 167072509
3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]-6-(3-phenylphenyl)carbazole
CID 167381390
3-carbazol-9-yl-9-[4-[4-(3,5-diphenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-6-phenylcarbazole
CID 146280568
9-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-2-(4-cyclohexa-2,4-dien-1-ylphenyl)-6-(4-phenylphenyl)phenyl]-3-phenylcarbazole
CID 167401664
3-carbazol-9-yl-9-[4-(4,6-diphenylpyrimidin-2-yl)-2,6-diphenylphenyl]-6-phenylcarbazole
CID 146280522
9-[4-[4,6-di(dibenzofuran-3-yl)-1,3,5-triazin-2-yl]-2-[(1S)-4-phenylcyclohexa-2,4-dien-1-yl]-6-(4-phenylphenyl)phenyl]-3-phenylcarbazole
CID 153304474
9-[2,6-bis(4-carbazol-9-ylphenyl)-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-bis(3-methylphenyl)carbazole
CID 158648184
3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,6-bis(4-phenylphenyl)phenyl]-5-phenylcarbazole
CID 146280519
3-carbazol-9-yl-9-[4-[4,6-di(dibenzofuran-3-yl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-6-phenylcarbazole
CID 146280367
9-[2-cyclohexa-1,5-dien-1-yl-4-(4-cyclohexa-1,5-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-phenylphenyl]-3,6-diphenylcarbazole
CID 177276855
9-[4-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]-3-phenylcarbazole
CID 146280577
6-carbazol-9-yl-9-[4-(2,6-diphenylpyrimidin-4-yl)-2,6-diphenylphenyl]-2-phenylcarbazole
CID 146280528

Frequently Asked Questions

What is the IUPAC name of 3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole?
The IUPAC name of 3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole (CID 167403511) is 3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole.
What is the SMILES notation for 3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole?
The canonical SMILES for 3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole is C1=CC(c2ccccc2)CC=C1c1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc(-c2ccc(-c3ccccc3)cc2)c1-n1c2ccc(-c3ccccc3)cc2c2cc(-n3c4ccccc4c4ccccc43)ccc21.
What is the InChIKey of 3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole?
The InChIKey is WMADSKWZFUNZJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C75H51N5/c1-6-20-50(21-7-1)53-34-38-55(39-35-53)64-47-60(75-77-73(57-26-12-4-13-27-57)76-74(78-75)58-28-14-5-15-29-58)48-65(56-40-36-54(37-41-56)51-22-8-2-9-23-51)72(64)80-70-44-42-59(52-24-10-3-11-25-52)46-66(70)67-49-61(43-45-71(67)80)79-68-32-18-16-30-62(68)63-31-17-19-33-69(63)79/h1-36,38-49,54H,37H2.
What are the key properties of 3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole?
3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole has a molecular weight of 1022.27 g/mol, XLogP of 19.19, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-carbazol-9-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-phenylcyclohexa-1,5-dien-1-yl)-6-(4-phenylphenyl)phenyl]-6-phenylcarbazole is sourced from PubChem (CID 167403511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).