9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole

C42H27N — CID 118014216

IUPAC9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole
SMILESc1ccc(-n2c3ccccc3c3cccc(-c4cccc(-c5ccc6c7ccccc7c7ccccc7c6c5)c4)c32)cc1
InChIInChI=1S/C42H27N/c1-2-14-31(15-3-1)43-41-23-9-8-20-38(41)39-22-11-21-32(42(39)43)30-13-10-12-28(26-30)29-24-25-37-35-18-5-4-16-33(35)34-17-6-7-19-36(34)40(37)27-29/h1-27H
InChIKeyRNFNVGSGUCLNFD-UHFFFAOYSA-N
MW545.69 g/mol
LogP11.58
Rot. Bonds3

About 9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole

9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole (PubChem CID 118014216) has the molecular formula C42H27N and a molecular weight of 545.69 g/mol. Its IUPAC name is 9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole.

Molecular Properties

Compound Name9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole
PubChem CID118014216
Molecular FormulaC42H27N
Molecular Weight545.69 g/mol
Exact Mass545.21
IUPAC Name9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole
SMILESc1ccc(-n2c3ccccc3c3cccc(-c4cccc(-c5ccc6c7ccccc7c7ccccc7c6c5)c4)c32)cc1
InChIInChI=1S/C42H27N/c1-2-14-31(15-3-1)43-41-23-9-8-20-38(41)39-22-11-21-32(42(39)43)30-13-10-12-28(26-30)29-24-25-37-35-18-5-4-16-33(35)34-17-6-7-19-36(34)40(37)27-29/h1-27H
InChIKeyRNFNVGSGUCLNFD-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-phenyl-1-[3-[3-phenyl-5-(9-phenylcarbazol-1-yl)phenyl]phenyl]carbazole
CID 71127197
1-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-[4-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]carbazole
CID 154590389
9-phenyl-1-[2-(3-phenylphenyl)phenyl]carbazole
CID 175012916
3-[9-(3,5-diphenylphenyl)carbazol-1-yl]-9-(4-phenylphenyl)carbazole;3-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole;9-(3-phenylphenyl)-1-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 159712744
6-[9-(3,5-diphenylphenyl)carbazol-3-yl]-1,9-diphenylcarbazole
CID 170072372
6-(9-methylcarbazol-3-yl)-9-phenyl-1-(9-phenylcarbazol-3-yl)carbazole
CID 126630373
9-phenyl-4-[3-[7-[3-(9-phenylcarbazol-4-yl)phenyl]triphenylen-2-yl]phenyl]carbazole
CID 118490695
3,9-diphenyl-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;3,9-diphenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole;1-phenyl-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 160580937
9-[4-(3,10-diphenylanthracen-9-yl)phenyl]-1-phenylcarbazole
CID 130377342
1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole
CID 137466576
9-phenyl-1-[3-[5-[3-(9-phenylcarbazol-1-yl)phenyl]furan-2-yl]phenyl]carbazole
CID 71127207
1-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;2-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;4-[9-(4-carbazol-9-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 159875127

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole?
The IUPAC name of 9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole (CID 118014216) is 9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole.
What is the SMILES notation for 9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole?
The canonical SMILES for 9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole is c1ccc(-n2c3ccccc3c3cccc(-c4cccc(-c5ccc6c7ccccc7c7ccccc7c6c5)c4)c32)cc1.
What is the InChIKey of 9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole?
The InChIKey is RNFNVGSGUCLNFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H27N/c1-2-14-31(15-3-1)43-41-23-9-8-20-38(41)39-22-11-21-32(42(39)43)30-13-10-12-28(26-30)29-24-25-37-35-18-5-4-16-33(35)34-17-6-7-19-36(34)40(37)27-29/h1-27H.
What are the key properties of 9-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole?
9-phenyl-1-(3-triphenylen-2-ylphenyl)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-phenyl-1-(3-triphenylen-2-ylphenyl)carbazole is sourced from PubChem (CID 118014216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).