3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole

C49H31N5 — CID 130355722

IUPAC3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5nc(-c6ccccc6)c6ccccc6n5)ccc43)n2)cc1
InChIInChI=1S/C49H31N5/c1-3-14-32(15-4-1)41-22-13-25-47(50-41)53-43-23-11-8-18-36(43)39-30-34(26-28-45(39)53)35-27-29-46-40(31-35)37-19-9-12-24-44(37)54(46)49-51-42-21-10-7-20-38(42)48(52-49)33-16-5-2-6-17-33/h1-31H
InChIKeyHIEXGBCTFRNLAH-UHFFFAOYSA-N
MW689.82 g/mol
LogP12.22
Rot. Bonds5

About 3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole

3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole (PubChem CID 130355722) has the molecular formula C49H31N5 and a molecular weight of 689.82 g/mol. Its IUPAC name is 3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole.

Molecular Properties

Compound Name3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole
PubChem CID130355722
Molecular FormulaC49H31N5
Molecular Weight689.82 g/mol
Exact Mass689.26
IUPAC Name3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5nc(-c6ccccc6)c6ccccc6n5)ccc43)n2)cc1
InChIInChI=1S/C49H31N5/c1-3-14-32(15-4-1)41-22-13-25-47(50-41)53-43-23-11-8-18-36(43)39-30-34(26-28-45(39)53)35-27-29-46-40(31-35)37-19-9-12-24-44(37)54(46)49-51-42-21-10-7-20-38(42)48(52-49)33-16-5-2-6-17-33/h1-31H
InChIKeyHIEXGBCTFRNLAH-UHFFFAOYSA-N
XLogP12.22
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500689.82
LogP ≤ 512.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole 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

3-(9-phenylcarbazol-3-yl)-9-[4-[4-(4-phenylphenyl)phenyl]quinazolin-2-yl]carbazole
CID 90050965
3-[3-(9-phenylcarbazol-3-yl)phenyl]-9-(6-phenyl-2-pyridinyl)carbazole
CID 126764108
3-[4-(9-phenylcarbazol-3-yl)phenyl]-9-[4-(3-phenylphenyl)quinazolin-2-yl]carbazole
CID 118067227
9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[4-[4-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]quinazolin-4-yl]phenyl]phenyl]carbazol-3-yl]carbazole
CID 146176762
3-(9-phenylcarbazol-3-yl)-9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazole
CID 118133212
2-[9-[4-(4-carbazol-9-ylphenyl)quinazolin-2-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-(4-carbazol-9-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-9-phenylcarbazole
CID 162263267
4-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]quinazolin-4-yl]phenol
CID 136980186
5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole
CID 58038356
3-[2-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9-(6-phenyl-2-pyridinyl)carbazole;3-[3-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9-(6-phenyl-2-pyridinyl)carbazole;3-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-9-(6-phenyl-2-pyridinyl)carbazole
CID 160598852
3-[9-(3,5-diphenylphenyl)carbazol-2-yl]-9-[4-(3-phenylphenyl)quinazolin-2-yl]carbazole
CID 90129291
5-[3-(9-phenylcarbazol-3-yl)phenyl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
CID 134353255
2-(9-phenylcarbazol-3-yl)-9-[4-[4-(5-phenyl-2-pyridinyl)phenyl]quinazolin-2-yl]carbazole
CID 90129224

Frequently Asked Questions

What is the IUPAC name of 3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole?
The IUPAC name of 3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole (CID 130355722) is 3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole.
What is the SMILES notation for 3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole?
The canonical SMILES for 3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole is c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5nc(-c6ccccc6)c6ccccc6n5)ccc43)n2)cc1.
What is the InChIKey of 3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole?
The InChIKey is HIEXGBCTFRNLAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H31N5/c1-3-14-32(15-4-1)41-22-13-25-47(50-41)53-43-23-11-8-18-36(43)39-30-34(26-28-45(39)53)35-27-29-46-40(31-35)37-19-9-12-24-44(37)54(46)49-51-42-21-10-7-20-38(42)48(52-49)33-16-5-2-6-17-33/h1-31H.
What are the key properties of 3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole?
3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole has a molecular weight of 689.82 g/mol, XLogP of 12.22, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylquinazolin-2-yl)carbazole is sourced from PubChem (CID 130355722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).