9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole

C41H26N2 — CID 58273441

IUPAC9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole
SMILESc1ccc2ncc(-c3c4ccccc4c(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccccc34)cc2c1
InChIInChI=1S/C41H26N2/c1-8-18-37-28(11-1)25-29(26-42-37)41-35-16-4-2-14-33(35)40(34-15-3-5-17-36(34)41)27-21-23-30(24-22-27)43-38-19-9-6-12-31(38)32-13-7-10-20-39(32)43/h1-26H
InChIKeyHDVNACHFOGSLCT-UHFFFAOYSA-N
MW546.67 g/mol
LogP10.97
Rot. Bonds3

About 9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole

9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole (PubChem CID 58273441) has the molecular formula C41H26N2 and a molecular weight of 546.67 g/mol. Its IUPAC name is 9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole
PubChem CID58273441
Molecular FormulaC41H26N2
Molecular Weight546.67 g/mol
Exact Mass546.21
IUPAC Name9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole
SMILESc1ccc2ncc(-c3c4ccccc4c(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccccc34)cc2c1
InChIInChI=1S/C41H26N2/c1-8-18-37-28(11-1)25-29(26-42-37)41-35-16-4-2-14-33(35)40(34-15-3-5-17-36(34)41)27-21-23-30(24-22-27)43-38-19-9-6-12-31(38)32-13-7-10-20-39(32)43/h1-26H
InChIKeyHDVNACHFOGSLCT-UHFFFAOYSA-N
XLogP10.97
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500546.67
LogP ≤ 510.97
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

3-[10-[4-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]phenyl]anthracen-9-yl]quinoline
CID 59861500
9-quinolin-3-ylcarbazole
CID 138984974
9-[4-[10-(4-isoquinolin-3-ylphenyl)anthracen-9-yl]phenyl]carbazole
CID 90249684
9-[4-[5-(10-naphthalen-2-ylanthracen-9-yl)-3-pyridinyl]phenyl]carbazole
CID 59372038
9-[4-[10-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]anthracen-9-yl]phenyl]carbazole
CID 58971557
2,3-bis[4-(10-phenylanthracen-9-yl)phenyl]quinoxaline;9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;2-phenyl-3-[4-(10-phenylanthracen-9-yl)phenyl]quinoxaline
CID 164980722
3-anthracen-9-ylquinoline
CID 170654314
7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline
CID 145180155
9-ethyl-3-(10-naphthalen-1-ylanthracen-9-yl)carbazole;3-(10-phenylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-phenyl-3,6-bis(10-phenylanthracen-9-yl)carbazole
CID 157185828
9-naphthalen-2-yl-3-(10-pyridin-3-ylanthracen-9-yl)carbazole;3-(10-pyridin-3-ylanthracen-9-yl)-9-quinolin-3-ylcarbazole;9-pyridin-3-yl-3-(10-pyridin-3-ylanthracen-9-yl)carbazole
CID 159111759
9-(4-dibenzofuran-3-ylphenyl)-3,6-di(quinolin-3-yl)carbazole
CID 171851975
14-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-10-phenyl-10,15-diazapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 129122547

Frequently Asked Questions

What is the IUPAC name of 9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole?
The IUPAC name of 9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole (CID 58273441) is 9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole.
What is the SMILES notation for 9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole?
The canonical SMILES for 9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole is c1ccc2ncc(-c3c4ccccc4c(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccccc34)cc2c1.
What is the InChIKey of 9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole?
The InChIKey is HDVNACHFOGSLCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H26N2/c1-8-18-37-28(11-1)25-29(26-42-37)41-35-16-4-2-14-33(35)40(34-15-3-5-17-36(34)41)27-21-23-30(24-22-27)43-38-19-9-6-12-31(38)32-13-7-10-20-39(32)43/h1-26H.
What are the key properties of 9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole?
9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole has a molecular weight of 546.67 g/mol, XLogP of 10.97, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole is sourced from PubChem (CID 58273441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).