2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+))

C152H116N21O5Pt5S5-9 — CID 157322452

IUPAC2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+))
SMILESCN1C=CN(c2[c-]c(Oc3[c-]c(-c4ncc(-c5cccnc5)s4)ccc3)ccc2)[CH-]1.CN1C=CN(c2[c-]c(Oc3[c-]c(-c4nccs4)ccc3)ccc2)[CH-]1.CN1C=CN(c2[c-]c(Oc3[c-]c(-c4nccs4)ccc3)ccc2)[CH-]1.Cc1cc(C)n(-c2[c-]c(Oc3[c-]c(-c4nccs4)ccc3)ccc2)n1.Cn1c2ccccc2c2ccccc21.Cn1c2ccccc2c2ccccc21.Cn1c2ccccc2c2ccccc21.Cn1c2ccccc2c2cccnc21.Cn1ccnc1-c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1.[Pt+2].[Pt+2].[Pt].[Pt].[Pt]
InChIInChI=1S/C24H17N4OS.C20H15N3OS.2C19H14N3OS.C19H13N3OS.3C13H11N.C12H10N2.5Pt/c1-27-11-12-28(17-27)20-7-3-9-22(14-20)29-21-8-2-5-18(13-21)24-26-16-23(30-24)19-6-4-10-25-15-19;1-14-11-15(2)23(22-14)17-6-4-8-19(13-17)24-18-7-3-5-16(12-18)20-21-9-10-25-20;2*1-21-9-10-22(14-21)16-5-3-7-18(13-16)23-17-6-2-4-15(12-17)19-20-8-11-24-19;1-22-10-8-20-18(22)14-4-2-6-16(12-14)23-17-7-3-5-15(13-17)19-21-9-11-24-19;3*1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;1-14-11-7-3-2-5-9(11)10-6-4-8-13-12(10)14;;;;;/h2-12,15-17H,1H3;3-11H,1-2H3;2*2-11,14H,1H3;2-11H,1H3;3*2-9H,1H3;2-8H,1H3;;;;;/q-3;-2;2*-3;-2;;;;;;;;2*+2
InChIKeyXATJRTPBILQVEC-UHFFFAOYSA-N
MW3452.47 g/mol
LogP37.01
Rot. Bonds21

About 2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+))

2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+)) (PubChem CID 157322452) has the molecular formula C152H116N21O5Pt5S5-9 and a molecular weight of 3452.47 g/mol. Its IUPAC name is 2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+)).

Molecular Properties

Compound Name2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+))
PubChem CID157322452
Molecular FormulaC152H116N21O5Pt5S5-9
Molecular Weight3452.47 g/mol
Exact Mass3449.64
IUPAC Name2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+))
SMILESCN1C=CN(c2[c-]c(Oc3[c-]c(-c4ncc(-c5cccnc5)s4)ccc3)ccc2)[CH-]1.CN1C=CN(c2[c-]c(Oc3[c-]c(-c4nccs4)ccc3)ccc2)[CH-]1.CN1C=CN(c2[c-]c(Oc3[c-]c(-c4nccs4)ccc3)ccc2)[CH-]1.Cc1cc(C)n(-c2[c-]c(Oc3[c-]c(-c4nccs4)ccc3)ccc2)n1.Cn1c2ccccc2c2ccccc21.Cn1c2ccccc2c2ccccc21.Cn1c2ccccc2c2ccccc21.Cn1c2ccccc2c2cccnc21.Cn1ccnc1-c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1.[Pt+2].[Pt+2].[Pt].[Pt].[Pt]
InChIInChI=1S/C24H17N4OS.C20H15N3OS.2C19H14N3OS.C19H13N3OS.3C13H11N.C12H10N2.5Pt/c1-27-11-12-28(17-27)20-7-3-9-22(14-20)29-21-8-2-5-18(13-21)24-26-16-23(30-24)19-6-4-10-25-15-19;1-14-11-15(2)23(22-14)17-6-4-8-19(13-17)24-18-7-3-5-16(12-18)20-21-9-10-25-20;2*1-21-9-10-22(14-21)16-5-3-7-18(13-16)23-17-6-2-4-15(12-17)19-20-8-11-24-19;1-22-10-8-20-18(22)14-4-2-6-16(12-14)23-17-7-3-5-15(13-17)19-21-9-11-24-19;3*1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;1-14-11-7-3-2-5-9(11)10-6-4-8-13-12(10)14;;;;;/h2-12,15-17H,1H3;3-11H,1-2H3;2*2-11,14H,1H3;2-11H,1H3;3*2-9H,1H3;2-8H,1H3;;;;;/q-3;-2;2*-3;-2;;;;;;;;2*+2
InChIKeyXATJRTPBILQVEC-UHFFFAOYSA-N
XLogP37.01
TPSA211.18 Ų
H-Bond Donors
H-Bond Acceptors31
Rotatable Bonds21
Heavy Atoms188
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003452.47
LogP ≤ 537.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

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

Analyze 2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+))?
The IUPAC name of 2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+)) (CID 157322452) is 2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+)).
What is the SMILES notation for 2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+))?
The canonical SMILES for 2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+)) is CN1C=CN(c2[c-]c(Oc3[c-]c(-c4ncc(-c5cccnc5)s4)ccc3)ccc2)[CH-]1.CN1C=CN(c2[c-]c(Oc3[c-]c(-c4nccs4)ccc3)ccc2)[CH-]1.CN1C=CN(c2[c-]c(Oc3[c-]c(-c4nccs4)ccc3)ccc2)[CH-]1.Cc1cc(C)n(-c2[c-]c(Oc3[c-]c(-c4nccs4)ccc3)ccc2)n1.Cn1c2ccccc2c2ccccc21.Cn1c2ccccc2c2ccccc21.Cn1c2ccccc2c2ccccc21.Cn1c2ccccc2c2cccnc21.Cn1ccnc1-c1[c-]c(Oc2[c-]c(-c3nccs3)ccc2)ccc1.[Pt+2].[Pt+2].[Pt].[Pt].[Pt].
What is the InChIKey of 2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+))?
The InChIKey is XATJRTPBILQVEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17N4OS.C20H15N3OS.2C19H14N3OS.C19H13N3OS.3C13H11N.C12H10N2.5Pt/c1-27-11-12-28(17-27)20-7-3-9-22(14-20)29-21-8-2-5-18(13-21)24-26-16-23(30-24)19-6-4-10-25-15-19;1-14-11-15(2)23(22-14)17-6-4-8-19(13-17)24-18-7-3-5-16(12-18)20-21-9-10-25-20;2*1-21-9-10-22(14-21)16-5-3-7-18(13-16)23-17-6-2-4-15(12-17)19-20-8-11-24-19;1-22-10-8-20-18(22)14-4-2-6-16(12-14)23-17-7-3-5-15(13-17)19-21-9-11-24-19;3*1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;1-14-11-7-3-2-5-9(11)10-6-4-8-13-12(10)14;;;;;/h2-12,15-17H,1H3;3-11H,1-2H3;2*2-11,14H,1H3;2-11H,1H3;3*2-9H,1H3;2-8H,1H3;;;;;/q-3;-2;2*-3;-2;;;;;;;;2*+2.
What are the key properties of 2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+))?
2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+)) has a molecular weight of 3452.47 g/mol, XLogP of 37.01, 21 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;tris(9-methylcarbazole);2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-pyridin-3-yl-1,3-thiazole;bis(2-[3-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole);2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;9-methylpyrido[2,3-b]indole;platinum;bis(platinum(2+)) is sourced from PubChem (CID 157322452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).