5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole

C43H28N4 — CID 59325965

IUPAC5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole
SMILESc1ccc(-c2nccc3c2c2ccccc2n3-c2ccc(-c3cc(-c4cccc5ccccc45)cc(-c4cccnc4)n3)cc2)cc1
InChIInChI=1S/C43H28N4/c1-2-11-31(12-3-1)43-42-37-16-6-7-18-40(37)47(41(42)23-25-45-43)34-21-19-30(20-22-34)38-26-33(27-39(46-38)32-14-9-24-44-28-32)36-17-8-13-29-10-4-5-15-35(29)36/h1-28H
InChIKeyKVMPVMLPYPMHQI-UHFFFAOYSA-N
MW600.73 g/mol
LogP10.79
Rot. Bonds5

About 5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole

5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole (PubChem CID 59325965) has the molecular formula C43H28N4 and a molecular weight of 600.73 g/mol. Its IUPAC name is 5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole.

Molecular Properties

Compound Name5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole
PubChem CID59325965
Molecular FormulaC43H28N4
Molecular Weight600.73 g/mol
Exact Mass600.23
IUPAC Name5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole
SMILESc1ccc(-c2nccc3c2c2ccccc2n3-c2ccc(-c3cc(-c4cccc5ccccc45)cc(-c4cccnc4)n3)cc2)cc1
InChIInChI=1S/C43H28N4/c1-2-11-31(12-3-1)43-42-37-16-6-7-18-40(37)47(41(42)23-25-45-43)34-21-19-30(20-22-34)38-26-33(27-39(46-38)32-14-9-24-44-28-32)36-17-8-13-29-10-4-5-15-35(29)36/h1-28H
InChIKeyKVMPVMLPYPMHQI-UHFFFAOYSA-N
XLogP10.79
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500600.73
LogP ≤ 510.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole with MolForge

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Related Compounds

5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]pyrido[4,3-b]indole
CID 59325982
7-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]benzo[c]carbazole
CID 121422958
5-[4-(2-naphthalen-2-yl-6-pyridin-2-yl-4-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole
CID 59326123
2-(3-naphthalen-1-ylphenyl)-4-(4-phenylphenyl)-6-(4-pyridin-3-ylphenyl)pyridine
CID 134320914
9-(2,6-dipyridin-3-yl-4-pyridinyl)carbazole
CID 135264911
9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
CID 118587050
2-naphthalen-1-yl-4-(4-naphthalen-1-ylphenyl)-6-pyridin-3-ylpyrimidine
CID 155089111
3-[4-[4-(2,6-dipyridin-3-yl-4-pyridinyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9-phenylcarbazole
CID 164843356
9-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-phenyl-14-[4-[6-phenyl-4-(3-phenylphenyl)-2-pyridinyl]phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 160842318
8-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-4-yl]-5-phenylpyrido[3,2-b]indole
CID 129221860
9-(4-naphthalen-1-ylphenyl)-5-phenyl-14-(4-phenylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 139312614
6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
CID 129221841

Frequently Asked Questions

What is the IUPAC name of 5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole?
The IUPAC name of 5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole (CID 59325965) is 5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole.
What is the SMILES notation for 5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole?
The canonical SMILES for 5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole is c1ccc(-c2nccc3c2c2ccccc2n3-c2ccc(-c3cc(-c4cccc5ccccc45)cc(-c4cccnc4)n3)cc2)cc1.
What is the InChIKey of 5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole?
The InChIKey is KVMPVMLPYPMHQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H28N4/c1-2-11-31(12-3-1)43-42-37-16-6-7-18-40(37)47(41(42)23-25-45-43)34-21-19-30(20-22-34)38-26-33(27-39(46-38)32-14-9-24-44-28-32)36-17-8-13-29-10-4-5-15-35(29)36/h1-28H.
What are the key properties of 5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole?
5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole has a molecular weight of 600.73 g/mol, XLogP of 10.79, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(4-naphthalen-1-yl-6-pyridin-3-yl-2-pyridinyl)phenyl]-1-phenylpyrido[4,3-b]indole is sourced from PubChem (CID 59325965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).