7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum

C143H97N21O4Pt4-4 — CID 157240017

IUPAC7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum
SMILESCN(C)c1ccc(-c2cc(-c3[c-]c(-c4cc5ccccc5nn4)cc(-c4ccccc4)c3)nc(-c3cc4nccnc4cc3O)c2)cc1.Cc1cc(C)c(-c2cc(-c3cc4ccccc4nn3)[c-]c(-c3cccc(-c4cc5nccnc5cc4O)n3)c2)c(C)c1.Cc1cccc(C)c1-c1cc(-c2[c-]c(-c3cc4ccccc4nn3)ccc2)nc(-c2cc3nccnc3cc2O)c1.Oc1cc2nc3ccccc3nc2cc1-c1cccc(-c2[c-]c(-c3cc4ccccc4nn3)ccc2)n1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C41H29N6O.C36H26N5O.C35H24N5O.C31H18N5O.4Pt/c1-47(2)33-14-12-27(13-15-33)30-22-36(44-38(23-30)34-24-39-40(25-41(34)48)43-17-16-42-39)31-18-29(26-8-4-3-5-9-26)19-32(20-31)37-21-28-10-6-7-11-35(28)45-46-37;1-21-13-22(2)36(23(3)14-21)27-16-25(15-26(17-27)32-18-24-7-4-5-8-30(24)40-41-32)29-9-6-10-31(39-29)28-19-33-34(20-35(28)42)38-12-11-37-33;1-21-7-5-8-22(2)35(21)26-17-29(38-31(18-26)27-19-32-33(20-34(27)41)37-14-13-36-32)23-10-6-11-24(15-23)30-16-25-9-3-4-12-28(25)39-40-30;37-31-18-30-29(33-26-11-3-4-12-27(26)34-30)17-22(31)25-14-6-13-23(32-25)19-8-5-9-20(15-19)28-16-21-7-1-2-10-24(21)35-36-28;;;;/h3-19,21-25,48H,1-2H3;4-14,16-20,42H,1-3H3;3-14,16-20,41H,1-2H3;1-14,16-18,37H;;;;/q4*-1;;;;
InChIKeyATVOHYRRRFIHAO-UHFFFAOYSA-N
MW2953.80 g/mol
LogP31.32
Rot. Bonds17

About 7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum

7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum (PubChem CID 157240017) has the molecular formula C143H97N21O4Pt4-4 and a molecular weight of 2953.80 g/mol. Its IUPAC name is 7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum.

Molecular Properties

Compound Name7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum
PubChem CID157240017
Molecular FormulaC143H97N21O4Pt4-4
Molecular Weight2953.80 g/mol
Exact Mass2951.66
IUPAC Name7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum
SMILESCN(C)c1ccc(-c2cc(-c3[c-]c(-c4cc5ccccc5nn4)cc(-c4ccccc4)c3)nc(-c3cc4nccnc4cc3O)c2)cc1.Cc1cc(C)c(-c2cc(-c3cc4ccccc4nn3)[c-]c(-c3cccc(-c4cc5nccnc5cc4O)n3)c2)c(C)c1.Cc1cccc(C)c1-c1cc(-c2[c-]c(-c3cc4ccccc4nn3)ccc2)nc(-c2cc3nccnc3cc2O)c1.Oc1cc2nc3ccccc3nc2cc1-c1cccc(-c2[c-]c(-c3cc4ccccc4nn3)ccc2)n1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C41H29N6O.C36H26N5O.C35H24N5O.C31H18N5O.4Pt/c1-47(2)33-14-12-27(13-15-33)30-22-36(44-38(23-30)34-24-39-40(25-41(34)48)43-17-16-42-39)31-18-29(26-8-4-3-5-9-26)19-32(20-31)37-21-28-10-6-7-11-35(28)45-46-37;1-21-13-22(2)36(23(3)14-21)27-16-25(15-26(17-27)32-18-24-7-4-5-8-30(24)40-41-32)29-9-6-10-31(39-29)28-19-33-34(20-35(28)42)38-12-11-37-33;1-21-7-5-8-22(2)35(21)26-17-29(38-31(18-26)27-19-32-33(20-34(27)41)37-14-13-36-32)23-10-6-11-24(15-23)30-16-25-9-3-4-12-28(25)39-40-30;37-31-18-30-29(33-26-11-3-4-12-27(26)34-30)17-22(31)25-14-6-13-23(32-25)19-8-5-9-20(15-19)28-16-21-7-1-2-10-24(21)35-36-28;;;;/h3-19,21-25,48H,1-2H3;4-14,16-20,42H,1-3H3;3-14,16-20,41H,1-2H3;1-14,16-18,37H;;;;/q4*-1;;;;
InChIKeyATVOHYRRRFIHAO-UHFFFAOYSA-N
XLogP31.32
TPSA341.96 Ų
H-Bond Donors4
H-Bond Acceptors25
Rotatable Bonds17
Heavy Atoms172
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002953.80
LogP ≤ 531.32
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum?
The IUPAC name of 7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum (CID 157240017) is 7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum.
What is the SMILES notation for 7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum?
The canonical SMILES for 7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum is CN(C)c1ccc(-c2cc(-c3[c-]c(-c4cc5ccccc5nn4)cc(-c4ccccc4)c3)nc(-c3cc4nccnc4cc3O)c2)cc1.Cc1cc(C)c(-c2cc(-c3cc4ccccc4nn3)[c-]c(-c3cccc(-c4cc5nccnc5cc4O)n3)c2)c(C)c1.Cc1cccc(C)c1-c1cc(-c2[c-]c(-c3cc4ccccc4nn3)ccc2)nc(-c2cc3nccnc3cc2O)c1.Oc1cc2nc3ccccc3nc2cc1-c1cccc(-c2[c-]c(-c3cc4ccccc4nn3)ccc2)n1.[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum?
The InChIKey is ATVOHYRRRFIHAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H29N6O.C36H26N5O.C35H24N5O.C31H18N5O.4Pt/c1-47(2)33-14-12-27(13-15-33)30-22-36(44-38(23-30)34-24-39-40(25-41(34)48)43-17-16-42-39)31-18-29(26-8-4-3-5-9-26)19-32(20-31)37-21-28-10-6-7-11-35(28)45-46-37;1-21-13-22(2)36(23(3)14-21)27-16-25(15-26(17-27)32-18-24-7-4-5-8-30(24)40-41-32)29-9-6-10-31(39-29)28-19-33-34(20-35(28)42)38-12-11-37-33;1-21-7-5-8-22(2)35(21)26-17-29(38-31(18-26)27-19-32-33(20-34(27)41)37-14-13-36-32)23-10-6-11-24(15-23)30-16-25-9-3-4-12-28(25)39-40-30;37-31-18-30-29(33-26-11-3-4-12-27(26)34-30)17-22(31)25-14-6-13-23(32-25)19-8-5-9-20(15-19)28-16-21-7-1-2-10-24(21)35-36-28;;;;/h3-19,21-25,48H,1-2H3;4-14,16-20,42H,1-3H3;3-14,16-20,41H,1-2H3;1-14,16-18,37H;;;;/q4*-1;;;;.
What are the key properties of 7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum?
7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum has a molecular weight of 2953.80 g/mol, XLogP of 31.32, 17 rotatable bonds, 4 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-4-(2,6-dimethylphenyl)-2-pyridinyl]quinoxalin-6-ol;3-[6-(3-cinnolin-3-ylbenzene-2-id-1-yl)-2-pyridinyl]phenazin-2-ol;7-[6-(3-cinnolin-3-yl-5-phenylbenzene-2-id-1-yl)-4-[4-(dimethylamino)phenyl]-2-pyridinyl]quinoxalin-6-ol;7-[6-[3-cinnolin-3-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]-2-pyridinyl]quinoxalin-6-ol;platinum is sourced from PubChem (CID 157240017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).