9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole

C43H28N2 — CID 58273653

IUPAC9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole
SMILESc1cc(-c2ccncc2)cc(-c2c3ccccc3c(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c3ccccc23)c1
InChIInChI=1S/C43H28N2/c1-3-19-38-36(17-1)42(31-12-9-11-30(27-31)29-23-25-44-26-24-29)37-18-2-4-20-39(37)43(38)32-13-10-14-33(28-32)45-40-21-7-5-15-34(40)35-16-6-8-22-41(35)45/h1-28H
InChIKeyLFHHUFFURXDZCU-UHFFFAOYSA-N
MW572.71 g/mol
LogP11.49
Rot. Bonds4

About 9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole

9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole (PubChem CID 58273653) has the molecular formula C43H28N2 and a molecular weight of 572.71 g/mol. Its IUPAC name is 9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole.

Molecular Properties

Compound Name9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole
PubChem CID58273653
Molecular FormulaC43H28N2
Molecular Weight572.71 g/mol
Exact Mass572.23
IUPAC Name9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole
SMILESc1cc(-c2ccncc2)cc(-c2c3ccccc3c(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c3ccccc23)c1
InChIInChI=1S/C43H28N2/c1-3-19-38-36(17-1)42(31-12-9-11-30(27-31)29-23-25-44-26-24-29)37-18-2-4-20-39(37)43(38)32-13-10-14-33(28-32)45-40-21-7-5-15-34(40)35-16-6-8-22-41(35)45/h1-28H
InChIKeyLFHHUFFURXDZCU-UHFFFAOYSA-N
XLogP11.49
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500572.71
LogP ≤ 511.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

9-[3-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]carbazole;9-[3-[10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]carbazole
CID 161402260
9-[3-[3-[5-[3-(3-carbazol-9-ylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]carbazole
CID 122622889
9-[3-(10-phenylanthracen-9-yl)phenyl]carbazole;9-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]carbazole;9-[3-[10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]carbazole
CID 159418617
5-[3,5-bis[3-(5-pyridin-4-yl-3-pyridinyl)phenyl]phenyl]pyrido[4,3-b]indole
CID 164785743
9-[4-[5-[4-(3-carbazol-9-ylphenyl)phenyl]-3-pyridinyl]phenyl]carbazole
CID 59372061
9-[3-[4-[4-[4-(3-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041263
9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole
CID 23386664
9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[9-(3-phenylphenyl)carbazol-3-yl]carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 158633984
9-(3-phenylphenyl)-6-[9-(3-phenylphenyl)carbazol-3-yl]pyrido[3,4-b]indole
CID 90336623
9-(3-phenylphenyl)-6-[4-[9-(3-phenylphenyl)carbazol-3-yl]phenyl]pyrido[3,4-b]indole
CID 146187368
3,6-bis(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 118699027
9-phenyl-3-[10-[4-[4-phenyl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]phenyl]anthracen-9-yl]carbazole
CID 164843390

Frequently Asked Questions

What is the IUPAC name of 9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole?
The IUPAC name of 9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole (CID 58273653) is 9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole.
What is the SMILES notation for 9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole?
The canonical SMILES for 9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole is c1cc(-c2ccncc2)cc(-c2c3ccccc3c(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c3ccccc23)c1.
What is the InChIKey of 9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole?
The InChIKey is LFHHUFFURXDZCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H28N2/c1-3-19-38-36(17-1)42(31-12-9-11-30(27-31)29-23-25-44-26-24-29)37-18-2-4-20-39(37)43(38)32-13-10-14-33(28-32)45-40-21-7-5-15-34(40)35-16-6-8-22-41(35)45/h1-28H.
What are the key properties of 9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole?
9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole has a molecular weight of 572.71 g/mol, XLogP of 11.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]carbazole is sourced from PubChem (CID 58273653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).