pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate

C151H101Li5N19O5+5 — CID 160905164

IUPACpentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate
SMILES[Li+].[Li+].[Li+].[Li+].[Li+].[O-]c1c(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)ccc2ccc[nH+]c12.[O-]c1c(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)ccc2ccc[nH+]c12.[O-]c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)c2ccc[nH+]c12.[O-]c1ccc(-c2cccc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)c2)c2ccc[nH+]c12.[O-]c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)c2ccc[nH+]c12
InChIInChI=1S/C31H21N3O.4C30H20N4O.5Li/c35-29-17-16-25(26-15-8-18-32-30(26)29)23-13-7-14-24(19-23)28-20-27(21-9-3-1-4-10-21)33-31(34-28)22-11-5-2-6-12-22;35-27-25(17-16-20-15-8-18-31-26(20)27)23-13-7-14-24(19-23)30-33-28(21-9-3-1-4-10-21)32-29(34-30)22-11-5-2-6-12-22;35-26-17-16-24(25-15-8-18-31-27(25)26)22-13-7-14-23(19-22)30-33-28(20-9-3-1-4-10-20)32-29(34-30)21-11-5-2-6-12-21;35-27-25(18-17-21-12-7-19-31-26(21)27)20-13-15-24(16-14-20)30-33-28(22-8-3-1-4-9-22)32-29(34-30)23-10-5-2-6-11-23;35-26-18-17-24(25-12-7-19-31-27(25)26)20-13-15-23(16-14-20)30-33-28(21-8-3-1-4-9-21)32-29(34-30)22-10-5-2-6-11-22;;;;;/h1-20,35H;4*1-19,35H;;;;;/q;;;;;5*+1
InChIKeySQASVAVWFIJURQ-UHFFFAOYSA-N
MW2296.30 g/mol
LogP13.53
Rot. Bonds20

About pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate

pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate (PubChem CID 160905164) has the molecular formula C151H101Li5N19O5+5 and a molecular weight of 2296.30 g/mol. Its IUPAC name is pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate.

Molecular Properties

Compound Namepentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate
PubChem CID160905164
Molecular FormulaC151H101Li5N19O5+5
Molecular Weight2296.30 g/mol
Exact Mass2294.90
IUPAC Namepentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate
SMILES[Li+].[Li+].[Li+].[Li+].[Li+].[O-]c1c(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)ccc2ccc[nH+]c12.[O-]c1c(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)ccc2ccc[nH+]c12.[O-]c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)c2ccc[nH+]c12.[O-]c1ccc(-c2cccc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)c2)c2ccc[nH+]c12.[O-]c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)c2ccc[nH+]c12
InChIInChI=1S/C31H21N3O.4C30H20N4O.5Li/c35-29-17-16-25(26-15-8-18-32-30(26)29)23-13-7-14-24(19-23)28-20-27(21-9-3-1-4-10-21)33-31(34-28)22-11-5-2-6-12-22;35-27-25(17-16-20-15-8-18-31-26(20)27)23-13-7-14-24(19-23)30-33-28(21-9-3-1-4-10-21)32-29(34-30)22-11-5-2-6-12-22;35-26-17-16-24(25-15-8-18-31-27(25)26)22-13-7-14-23(19-22)30-33-28(20-9-3-1-4-10-20)32-29(34-30)21-11-5-2-6-12-21;35-27-25(18-17-21-12-7-19-31-26(21)27)20-13-15-24(16-14-20)30-33-28(22-8-3-1-4-9-22)32-29(34-30)23-10-5-2-6-11-23;35-26-18-17-24(25-12-7-19-31-27(25)26)20-13-15-23(16-14-20)30-33-28(21-8-3-1-4-9-21)32-29(34-30)22-10-5-2-6-11-22;;;;;/h1-20,35H;4*1-19,35H;;;;;/q;;;;;5*+1
InChIKeySQASVAVWFIJURQ-UHFFFAOYSA-N
XLogP13.53
TPSA366.46 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds20
Heavy Atoms180
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002296.30
LogP ≤ 513.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate 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

lithium 5-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)anthracen-9-yl]quinolin-1-ium-8-olate
CID 140600508
2-[3-[4-[3-(4,6-diphenyl-2-pyridinyl)phenyl]naphthalen-1-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 58943423
2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-4-phenyl-6-(4-phenylnaphthalen-1-yl)-1,3,5-triazine
CID 164975629
2-[3-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;bis(2-[3-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine);2-[3-[4-(6-naphthalen-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 163499320
2-naphthalen-1-yl-4-(3-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 130465785
2-[4-[6-(3-naphthalen-2-ylphenyl)naphthalen-2-yl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine
CID 174244175
2-[4-[4-(4,6-diphenylpyrimidin-2-yl)naphthalen-1-yl]naphthalen-1-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine
CID 126681837
3-phenyl-1-[4-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]phenyl]benzo[f]quinoline
CID 138643926
2-[1-[4-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]naphthalen-2-yl]-4,6-diphenyl-1,3,5-triazine
CID 170277443
2-[1-[4-[3-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]phenyl]naphthalen-2-yl]-4,6-diphenyl-1,3,5-triazine
CID 170277694
2,4-diphenyl-6-[4-[3-[6-phenyl-2-[3-(2-phenylphenyl)phenyl]pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[4-[3-[6-phenyl-2-[4-(2-phenylphenyl)phenyl]pyrimidin-4-yl]phenyl]phenyl]-1,3,5-triazine;2-[4-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-4-phenyl-6-[4-(2-phenylphenyl)phenyl]-1,3,5-triazine
CID 163852198
2-[3-[5-[3-(4,6-diphenyl-2-pyridinyl)phenyl]naphthalen-2-yl]phenyl]-4,6-diphenylpyridine;2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-4,6-diphenyl-1,3,5-triazine;2-naphthalen-1-yl-4-[5-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-[5-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-6-phenyl-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3,5-triazine
CID 158729829

Frequently Asked Questions

What is the IUPAC name of pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate?
The IUPAC name of pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate (CID 160905164) is pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate.
What is the SMILES notation for pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate?
The canonical SMILES for pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate is [Li+].[Li+].[Li+].[Li+].[Li+].[O-]c1c(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)ccc2ccc[nH+]c12.[O-]c1c(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)ccc2ccc[nH+]c12.[O-]c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)c2ccc[nH+]c12.[O-]c1ccc(-c2cccc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)c2)c2ccc[nH+]c12.[O-]c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)c2ccc[nH+]c12.
What is the InChIKey of pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate?
The InChIKey is SQASVAVWFIJURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21N3O.4C30H20N4O.5Li/c35-29-17-16-25(26-15-8-18-32-30(26)29)23-13-7-14-24(19-23)28-20-27(21-9-3-1-4-10-21)33-31(34-28)22-11-5-2-6-12-22;35-27-25(17-16-20-15-8-18-31-26(20)27)23-13-7-14-24(19-23)30-33-28(21-9-3-1-4-10-21)32-29(34-30)22-11-5-2-6-12-22;35-26-17-16-24(25-15-8-18-31-27(25)26)22-13-7-14-23(19-22)30-33-28(20-9-3-1-4-10-20)32-29(34-30)21-11-5-2-6-12-21;35-27-25(18-17-21-12-7-19-31-26(21)27)20-13-15-24(16-14-20)30-33-28(22-8-3-1-4-9-22)32-29(34-30)23-10-5-2-6-11-23;35-26-18-17-24(25-12-7-19-31-27(25)26)20-13-15-23(16-14-20)30-33-28(21-8-3-1-4-9-21)32-29(34-30)22-10-5-2-6-11-22;;;;;/h1-20,35H;4*1-19,35H;;;;;/q;;;;;5*+1.
What are the key properties of pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate?
pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate has a molecular weight of 2296.30 g/mol, XLogP of 13.53, 20 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for pentalithium;5-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]quinolin-1-ium-8-olate;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinolin-1-ium-8-olate is sourced from PubChem (CID 160905164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).