2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+))

C111H66N18Pt3S6 — CID 158176578

IUPAC2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+))
SMILESCn1c(-c2[c-]c3c(cc2)c2cc(-c4nccs4)ccc2n3-c2[c-]c(-c3ccc(-c4nccs4)cn3)ccc2)nc2ccccc21.Cn1c(-c2[c-]c3c(cc2)c2cc(-c4nccs4)ccc2n3-c2[c-]c(-c3ccccn3)ccc2)nc2ccc(-c3nccs3)cc21.Cn1c(-c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-c3ccc(-c4nccs4)cn3)ccc2-c2nccs2)nc2ccccc21.[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/3C37H22N6S2.3Pt/c1-42-32-9-5-3-7-30(32)41-35(42)24-11-13-27-26-6-2-4-8-31(26)43(33(27)21-24)34-20-23(10-14-28(34)37-39-17-19-45-37)29-15-12-25(22-40-29)36-38-16-18-44-36;1-42-34-22-26(37-40-16-18-45-37)9-12-31(34)41-35(42)24-8-11-28-29-20-25(36-39-15-17-44-36)10-13-32(29)43(33(28)21-24)27-6-4-5-23(19-27)30-7-2-3-14-38-30;1-42-33-8-3-2-7-31(33)41-35(42)24-9-12-28-29-20-25(36-38-15-17-44-36)11-14-32(29)43(34(28)21-24)27-6-4-5-23(19-27)30-13-10-26(22-40-30)37-39-16-18-45-37;;;/h2-19,22H,1H3;2*2-18,20,22H,1H3;;;/q3*-2;3*+2
InChIKeyXZLOGFBBSZCRRJ-UHFFFAOYSA-N
MW2429.51 g/mol
LogP27.73
Rot. Bonds15

About 2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+))

2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+)) (PubChem CID 158176578) has the molecular formula C111H66N18Pt3S6 and a molecular weight of 2429.51 g/mol. Its IUPAC name is 2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+)).

Molecular Properties

Compound Name2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+))
PubChem CID158176578
Molecular FormulaC111H66N18Pt3S6
Molecular Weight2429.51 g/mol
Exact Mass2427.30
IUPAC Name2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+))
SMILESCn1c(-c2[c-]c3c(cc2)c2cc(-c4nccs4)ccc2n3-c2[c-]c(-c3ccc(-c4nccs4)cn3)ccc2)nc2ccccc21.Cn1c(-c2[c-]c3c(cc2)c2cc(-c4nccs4)ccc2n3-c2[c-]c(-c3ccccn3)ccc2)nc2ccc(-c3nccs3)cc21.Cn1c(-c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-c3ccc(-c4nccs4)cn3)ccc2-c2nccs2)nc2ccccc21.[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/3C37H22N6S2.3Pt/c1-42-32-9-5-3-7-30(32)41-35(42)24-11-13-27-26-6-2-4-8-31(26)43(33(27)21-24)34-20-23(10-14-28(34)37-39-17-19-45-37)29-15-12-25(22-40-29)36-38-16-18-44-36;1-42-34-22-26(37-40-16-18-45-37)9-12-31(34)41-35(42)24-8-11-28-29-20-25(36-39-15-17-44-36)10-13-32(29)43(33(28)21-24)27-6-4-5-23(19-27)30-7-2-3-14-38-30;1-42-33-8-3-2-7-31(33)41-35(42)24-9-12-28-29-20-25(36-38-15-17-44-36)11-14-32(29)43(34(28)21-24)27-6-4-5-23(19-27)30-13-10-26(22-40-30)37-39-16-18-45-37;;;/h2-19,22H,1H3;2*2-18,20,22H,1H3;;;/q3*-2;3*+2
InChIKeyXZLOGFBBSZCRRJ-UHFFFAOYSA-N
XLogP27.73
TPSA184.26 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds15
Heavy Atoms138
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002429.51
LogP ≤ 527.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

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

Analyze 2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+))?
The IUPAC name of 2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+)) (CID 158176578) is 2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+)).
What is the SMILES notation for 2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+))?
The canonical SMILES for 2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+)) is Cn1c(-c2[c-]c3c(cc2)c2cc(-c4nccs4)ccc2n3-c2[c-]c(-c3ccc(-c4nccs4)cn3)ccc2)nc2ccccc21.Cn1c(-c2[c-]c3c(cc2)c2cc(-c4nccs4)ccc2n3-c2[c-]c(-c3ccccn3)ccc2)nc2ccc(-c3nccs3)cc21.Cn1c(-c2[c-]c3c(cc2)c2ccccc2n3-c2[c-]c(-c3ccc(-c4nccs4)cn3)ccc2-c2nccs2)nc2ccccc21.[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+))?
The InChIKey is XZLOGFBBSZCRRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C37H22N6S2.3Pt/c1-42-32-9-5-3-7-30(32)41-35(42)24-11-13-27-26-6-2-4-8-31(26)43(33(27)21-24)34-20-23(10-14-28(34)37-39-17-19-45-37)29-15-12-25(22-40-29)36-38-16-18-44-36;1-42-34-22-26(37-40-16-18-45-37)9-12-31(34)41-35(42)24-8-11-28-29-20-25(36-39-15-17-44-36)10-13-32(29)43(33(28)21-24)27-6-4-5-23(19-27)30-7-2-3-14-38-30;1-42-33-8-3-2-7-31(33)41-35(42)24-9-12-28-29-20-25(36-38-15-17-44-36)11-14-32(29)43(34(28)21-24)27-6-4-5-23(19-27)30-13-10-26(22-40-30)37-39-16-18-45-37;;;/h2-19,22H,1H3;2*2-18,20,22H,1H3;;;/q3*-2;3*+2.
What are the key properties of 2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+))?
2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+)) has a molecular weight of 2429.51 g/mol, XLogP of 27.73, 15 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(1,3-thiazol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[6-[3-[2-(1-methylbenzimidazol-2-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-thiazole;2-[3-methyl-2-[9-(3-pyridin-2-ylbenzene-2-id-1-yl)-6-(1,3-thiazol-2-yl)-1H-carbazol-1-id-2-yl]benzimidazol-5-yl]-1,3-thiazole;tris(platinum(2+)) is sourced from PubChem (CID 158176578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).