7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline

C55H36N4 — CID 156551768

IUPAC7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline
SMILESc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5-c5nc6ccccc6c6c7ccccc7n(-c7ccccc7)c56)cc4)nc(-c4ccccc4)n3)cc2)cc1
InChIInChI=1S/C55H36N4/c1-4-16-37(17-5-1)38-28-32-40(33-29-38)49-36-50(58-55(57-49)42-18-6-2-7-19-42)41-34-30-39(31-35-41)44-22-10-11-23-45(44)53-54-52(46-24-12-14-26-48(46)56-53)47-25-13-15-27-51(47)59(54)43-20-8-3-9-21-43/h1-36H
InChIKeyRZIKHOKMAYADOW-UHFFFAOYSA-N
MW752.92 g/mol
LogP14.12
Rot. Bonds7

About 7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline

7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline (PubChem CID 156551768) has the molecular formula C55H36N4 and a molecular weight of 752.92 g/mol. Its IUPAC name is 7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline.

Molecular Properties

Compound Name7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline
PubChem CID156551768
Molecular FormulaC55H36N4
Molecular Weight752.92 g/mol
Exact Mass752.29
IUPAC Name7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline
SMILESc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5-c5nc6ccccc6c6c7ccccc7n(-c7ccccc7)c56)cc4)nc(-c4ccccc4)n3)cc2)cc1
InChIInChI=1S/C55H36N4/c1-4-16-37(17-5-1)38-28-32-40(33-29-38)49-36-50(58-55(57-49)42-18-6-2-7-19-42)41-34-30-39(31-35-41)44-22-10-11-23-45(44)53-54-52(46-24-12-14-26-48(46)56-53)47-25-13-15-27-51(47)59(54)43-20-8-3-9-21-43/h1-36H
InChIKeyRZIKHOKMAYADOW-UHFFFAOYSA-N
XLogP14.12
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500752.92
LogP ≤ 514.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

7-phenyl-6-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]naphthalen-1-yl]indolo[2,3-c]quinoline
CID 156551675
7-phenyl-6-[4-[4-[6-phenyl-2-(4-triphenylen-2-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline
CID 156551745
6-[2-[4-[2-[(2E,4Z)-hexa-2,4-dien-3-yl]-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]-7-phenylindolo[2,3-c]quinoline
CID 146480662
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-[4-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-7-phenylindolo[2,3-c]quinoline
CID 156551653
6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline
CID 159236321
6-[4-[4-(3,5-diphenylphenyl)-6-phenylpyrimidin-2-yl]phenyl]-11-phenylindolo[3,2-c]quinoline
CID 156551663
6-phenyl-7-[4-[4-phenyl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]indolo[2,3-c]quinoline
CID 156551716
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
3,14-diphenyl-5-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-3,15-diazapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4(9),5,7,11,14,16,18,20-decaene
CID 164723872
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

Frequently Asked Questions

What is the IUPAC name of 7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline?
The IUPAC name of 7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline (CID 156551768) is 7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline.
What is the SMILES notation for 7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline?
The canonical SMILES for 7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline is c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5-c5nc6ccccc6c6c7ccccc7n(-c7ccccc7)c56)cc4)nc(-c4ccccc4)n3)cc2)cc1.
What is the InChIKey of 7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline?
The InChIKey is RZIKHOKMAYADOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H36N4/c1-4-16-37(17-5-1)38-28-32-40(33-29-38)49-36-50(58-55(57-49)42-18-6-2-7-19-42)41-34-30-39(31-35-41)44-22-10-11-23-45(44)53-54-52(46-24-12-14-26-48(46)56-53)47-25-13-15-27-51(47)59(54)43-20-8-3-9-21-43/h1-36H.
What are the key properties of 7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline?
7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline has a molecular weight of 752.92 g/mol, XLogP of 14.12, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-6-[2-[4-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]indolo[2,3-c]quinoline is sourced from PubChem (CID 156551768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).