6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline

C44H29N3 — CID 146480920

IUPAC6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline
SMILESc1ccc(-c2cc(-c3ccc(-c4nc5ccccc5c5c4c4ccccc4n5-c4ccccc4)cc3)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C44H29N3/c1-4-14-31(15-5-1)39-28-34(29-40(45-39)32-16-6-2-7-17-32)30-24-26-33(27-25-30)43-42-37-21-11-13-23-41(37)47(35-18-8-3-9-19-35)44(42)36-20-10-12-22-38(36)46-43/h1-29H
InChIKeySIUSVLRXGJIIKX-UHFFFAOYSA-N
MW599.74 g/mol
LogP11.39
Rot. Bonds5

About 6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline

6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline (PubChem CID 146480920) has the molecular formula C44H29N3 and a molecular weight of 599.74 g/mol. Its IUPAC name is 6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline.

Molecular Properties

Compound Name6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline
PubChem CID146480920
Molecular FormulaC44H29N3
Molecular Weight599.74 g/mol
Exact Mass599.24
IUPAC Name6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline
SMILESc1ccc(-c2cc(-c3ccc(-c4nc5ccccc5c5c4c4ccccc4n5-c4ccccc4)cc3)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C44H29N3/c1-4-14-31(15-5-1)39-28-34(29-40(45-39)32-16-6-2-7-17-32)30-24-26-33(27-25-30)43-42-37-21-11-13-23-41(37)47(35-18-8-3-9-19-35)44(42)36-20-10-12-22-38(36)46-43/h1-29H
InChIKeySIUSVLRXGJIIKX-UHFFFAOYSA-N
XLogP11.39
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500599.74
LogP ≤ 511.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-[4-[4-(3,5-diphenylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-11-phenylindolo[3,2-c]quinoline
CID 156551663
6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-11-phenylindolo[3,2-c]quinoline
CID 146480609
6-[4-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]-11-phenylindolo[3,2-c]quinoline
CID 146480611
6-phenyl-11-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]indolo[3,2-c]quinoline;6-phenyl-11-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]indolo[3,2-c]quinoline
CID 159724561
11-[4-[4-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]-6-phenylindolo[3,2-c]quinoline;11-[4-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenylindolo[3,2-c]quinoline;methane
CID 158015741
12-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-11-phenylindolo[2,3-i]phenanthridine
CID 129122989
11-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-6-phenanthren-3-ylindolo[3,2-c]quinoline
CID 156551590
3-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-11-phenyl-3,12-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(21),2(10),4,6,8,11,13,15,17,19-decaene
CID 156551219
14-[4-(4,6-diphenyl-2-pyridinyl)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 129122609
3-[3-(4,6-diphenyl-2-pyridinyl)phenyl]-14-phenyl-3,15-diazapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16,18,20-decaene
CID 129124079
12-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[2,3-a]carbazole
CID 118501935
11-phenyl-3-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]-3,12-diazapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16,18,20-decaene
CID 146480756

Frequently Asked Questions

What is the IUPAC name of 6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline?
The IUPAC name of 6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline (CID 146480920) is 6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline.
What is the SMILES notation for 6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline?
The canonical SMILES for 6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline is c1ccc(-c2cc(-c3ccc(-c4nc5ccccc5c5c4c4ccccc4n5-c4ccccc4)cc3)cc(-c3ccccc3)n2)cc1.
What is the InChIKey of 6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline?
The InChIKey is SIUSVLRXGJIIKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H29N3/c1-4-14-31(15-5-1)39-28-34(29-40(45-39)32-16-6-2-7-17-32)30-24-26-33(27-25-30)43-42-37-21-11-13-23-41(37)47(35-18-8-3-9-19-35)44(42)36-20-10-12-22-38(36)46-43/h1-29H.
What are the key properties of 6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline?
6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline has a molecular weight of 599.74 g/mol, XLogP of 11.39, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[3,2-c]quinoline is sourced from PubChem (CID 146480920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).