9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole

C42H27N — CID 174278174

IUPAC9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole
SMILESc1ccc(-c2ccc3c4ccc(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc4c4ccccc4c3c2)cc1
InChIInChI=1S/C42H27N/c1-2-11-28(12-3-1)30-21-23-35-36-24-22-31(27-40(36)34-16-5-4-15-33(34)39(35)26-30)29-13-10-14-32(25-29)43-41-19-8-6-17-37(41)38-18-7-9-20-42(38)43/h1-27H
InChIKeyQUFOEXJZSOOSKR-UHFFFAOYSA-N
MW545.69 g/mol
LogP11.58
Rot. Bonds3

About 9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole

9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole (PubChem CID 174278174) has the molecular formula C42H27N and a molecular weight of 545.69 g/mol. Its IUPAC name is 9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole
PubChem CID174278174
Molecular FormulaC42H27N
Molecular Weight545.69 g/mol
Exact Mass545.21
IUPAC Name9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole
SMILESc1ccc(-c2ccc3c4ccc(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc4c4ccccc4c3c2)cc1
InChIInChI=1S/C42H27N/c1-2-11-28(12-3-1)30-21-23-35-36-24-22-31(27-40(36)34-16-5-4-15-33(34)39(35)26-30)29-13-10-14-32(25-29)43-41-19-8-6-17-37(41)38-18-7-9-20-42(38)43/h1-27H
InChIKeyQUFOEXJZSOOSKR-UHFFFAOYSA-N
XLogP11.58
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500545.69
LogP ≤ 511.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

9-(3-triphenylen-2-ylphenyl)carbazole
CID 88924379
3,6-diphenyl-9-[3-[3-(3-triphenylen-2-ylphenyl)phenyl]phenyl]carbazole;3-phenyl-9-[3-[3-(3-triphenylen-2-ylphenyl)phenyl]phenyl]carbazole
CID 160984322
9-(3-phenylphenyl)-2-[4-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]carbazole
CID 165386024
9-[3-[4-[4-[4-(3-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041263
9-(3-phenylphenyl)-2-[4-[9-(3-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 165386227
3,9-diphenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 118449494
3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole
CID 164968359
3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161279377
2-[9-(4-phenylphenyl)carbazol-2-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole
CID 155241336
9-[3-(3,5-diphenylphenyl)phenyl]-3-[9-[3-[3-[3-[9-[3-(3,5-diphenylphenyl)phenyl]-6-phenylcarbazol-3-yl]carbazol-9-yl]phenyl]phenyl]carbazol-3-yl]-6-phenylcarbazole
CID 129265445
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161418420
9-(3-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 118014168

Frequently Asked Questions

What is the IUPAC name of 9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole?
The IUPAC name of 9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole (CID 174278174) is 9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole.
What is the SMILES notation for 9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole?
The canonical SMILES for 9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole is c1ccc(-c2ccc3c4ccc(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc4c4ccccc4c3c2)cc1.
What is the InChIKey of 9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole?
The InChIKey is QUFOEXJZSOOSKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H27N/c1-2-11-28(12-3-1)30-21-23-35-36-24-22-31(27-40(36)34-16-5-4-15-33(34)39(35)26-30)29-13-10-14-32(25-29)43-41-19-8-6-17-37(41)38-18-7-9-20-42(38)43/h1-27H.
What are the key properties of 9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole?
9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole has a molecular weight of 545.69 g/mol, XLogP of 11.58, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-(7-phenyltriphenylen-2-yl)phenyl]carbazole is sourced from PubChem (CID 174278174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).