2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole

C143H116N10O5Pt5S5 — CID 159169019

IUPAC2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole
SMILESCC1(C)c2ccccc2C(c2[c-]c(Oc3[c-]c(-c4nccs4)ccc3)ccc2)(c2ccccn2)c2ccccc21.CCCCC(CCCC)(c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1)c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c(C(c3ccccc3)c3ccccn3)ccc2)cccc1-c1nccs1.[c-]1c(Oc2[c-]c(C3(c4ccccn4)CCCC3)ccc2)cccc1-c1nccs1.[c-]1c(Oc2[c-]c(C3(c4ccccn4)CCCCC3)ccc2)cccc1-c1nccs1
InChIInChI=1S/C36H26N2OS.C29H30N2OS.C27H18N2OS.C26H22N2OS.C25H20N2OS.5Pt/c1-35(2)29-15-3-5-17-31(29)36(33-19-7-8-20-37-33,32-18-6-4-16-30(32)35)26-12-10-14-28(24-26)39-27-13-9-11-25(23-27)34-38-21-22-40-34;1-3-5-16-29(17-6-4-2,27-15-7-8-18-30-27)24-12-10-14-26(22-24)32-25-13-9-11-23(21-25)28-31-19-20-33-28;1-2-8-20(9-3-1)26(25-14-4-5-15-28-25)21-10-6-12-23(18-21)30-24-13-7-11-22(19-24)27-29-16-17-31-27;1-3-13-26(14-4-1,24-12-2-5-15-27-24)21-9-7-11-23(19-21)29-22-10-6-8-20(18-22)25-28-16-17-30-25;1-4-14-26-23(11-1)25(12-2-3-13-25)20-8-6-10-22(18-20)28-21-9-5-7-19(17-21)24-27-15-16-29-24;;;;;/h3-22H,1-2H3;7-15,18-20H,3-6,16-17H2,1-2H3;1-17,26H;2,5-12,15-17H,1,3-4,13-14H2;1,4-11,14-16H,2-3,12-13H2;;;;;/q5*-2;5*+2
InChIKeyBJHDGGHENUFMQK-UHFFFAOYSA-N
MW3190.29 g/mol
LogP36.96
Rot. Bonds32

About 2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole

2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole (PubChem CID 159169019) has the molecular formula C143H116N10O5Pt5S5 and a molecular weight of 3190.29 g/mol. Its IUPAC name is 2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole.

Molecular Properties

Compound Name2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole
PubChem CID159169019
Molecular FormulaC143H116N10O5Pt5S5
Molecular Weight3190.29 g/mol
Exact Mass3187.60
IUPAC Name2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole
SMILESCC1(C)c2ccccc2C(c2[c-]c(Oc3[c-]c(-c4nccs4)ccc3)ccc2)(c2ccccn2)c2ccccc21.CCCCC(CCCC)(c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1)c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c(C(c3ccccc3)c3ccccn3)ccc2)cccc1-c1nccs1.[c-]1c(Oc2[c-]c(C3(c4ccccn4)CCCC3)ccc2)cccc1-c1nccs1.[c-]1c(Oc2[c-]c(C3(c4ccccn4)CCCCC3)ccc2)cccc1-c1nccs1
InChIInChI=1S/C36H26N2OS.C29H30N2OS.C27H18N2OS.C26H22N2OS.C25H20N2OS.5Pt/c1-35(2)29-15-3-5-17-31(29)36(33-19-7-8-20-37-33,32-18-6-4-16-30(32)35)26-12-10-14-28(24-26)39-27-13-9-11-25(23-27)34-38-21-22-40-34;1-3-5-16-29(17-6-4-2,27-15-7-8-18-30-27)24-12-10-14-26(22-24)32-25-13-9-11-23(21-25)28-31-19-20-33-28;1-2-8-20(9-3-1)26(25-14-4-5-15-28-25)21-10-6-12-23(18-21)30-24-13-7-11-22(19-24)27-29-16-17-31-27;1-3-13-26(14-4-1,24-12-2-5-15-27-24)21-9-7-11-23(19-21)29-22-10-6-8-20(18-22)25-28-16-17-30-25;1-4-14-26-23(11-1)25(12-2-3-13-25)20-8-6-10-22(18-20)28-21-9-5-7-19(17-21)24-27-15-16-29-24;;;;;/h3-22H,1-2H3;7-15,18-20H,3-6,16-17H2,1-2H3;1-17,26H;2,5-12,15-17H,1,3-4,13-14H2;1,4-11,14-16H,2-3,12-13H2;;;;;/q5*-2;5*+2
InChIKeyBJHDGGHENUFMQK-UHFFFAOYSA-N
XLogP36.96
TPSA175.05 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds32
Heavy Atoms168
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003190.29
LogP ≤ 536.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze 2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole?
The IUPAC name of 2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole (CID 159169019) is 2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole.
What is the SMILES notation for 2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole?
The canonical SMILES for 2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole is CC1(C)c2ccccc2C(c2[c-]c(Oc3[c-]c(-c4nccs4)ccc3)ccc2)(c2ccccn2)c2ccccc21.CCCCC(CCCC)(c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1)c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c(C(c3ccccc3)c3ccccn3)ccc2)cccc1-c1nccs1.[c-]1c(Oc2[c-]c(C3(c4ccccn4)CCCC3)ccc2)cccc1-c1nccs1.[c-]1c(Oc2[c-]c(C3(c4ccccn4)CCCCC3)ccc2)cccc1-c1nccs1.
What is the InChIKey of 2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole?
The InChIKey is BJHDGGHENUFMQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26N2OS.C29H30N2OS.C27H18N2OS.C26H22N2OS.C25H20N2OS.5Pt/c1-35(2)29-15-3-5-17-31(29)36(33-19-7-8-20-37-33,32-18-6-4-16-30(32)35)26-12-10-14-28(24-26)39-27-13-9-11-25(23-27)34-38-21-22-40-34;1-3-5-16-29(17-6-4-2,27-15-7-8-18-30-27)24-12-10-14-26(22-24)32-25-13-9-11-23(21-25)28-31-19-20-33-28;1-2-8-20(9-3-1)26(25-14-4-5-15-28-25)21-10-6-12-23(18-21)30-24-13-7-11-22(19-24)27-29-16-17-31-27;1-3-13-26(14-4-1,24-12-2-5-15-27-24)21-9-7-11-23(19-21)29-22-10-6-8-20(18-22)25-28-16-17-30-25;1-4-14-26-23(11-1)25(12-2-3-13-25)20-8-6-10-22(18-20)28-21-9-5-7-19(17-21)24-27-15-16-29-24;;;;;/h3-22H,1-2H3;7-15,18-20H,3-6,16-17H2,1-2H3;1-17,26H;2,5-12,15-17H,1,3-4,13-14H2;1,4-11,14-16H,2-3,12-13H2;;;;;/q5*-2;5*+2.
What are the key properties of 2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole?
2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole has a molecular weight of 3190.29 g/mol, XLogP of 36.96, 32 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-[phenyl(pyridin-2-yl)methyl]benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;pentakis(platinum(2+));2-[3-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole is sourced from PubChem (CID 159169019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).