4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum

C167H131N20O5Pt5-5 — CID 158815353

IUPAC4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum
SMILESCc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)cc(-c5ccccc5)c4)cccc3n2-c2ccccc2)c(O)cn1.Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)cc(C(C)(C)C)c4)cccc3n2-c2ccccc2)c(O)cn1.Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)cc(C(C)C)c4)cccc3n2-c2ccccc2)c(O)cn1.Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)cc(CC(C)C)c4)cccc3n2-c2ccccc2)c(O)cn1.Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)ccc4)cccc3n2-c2ccccc2)c(O)cn1.[Pt].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C36H25N4O.2C34H29N4O.C33H27N4O.C30H21N4O.5Pt/c1-24-19-31(34(41)23-38-24)36-39-35-30(15-10-17-33(35)40(36)29-13-6-3-7-14-29)27-20-26(25-11-4-2-5-12-25)21-28(22-27)32-16-8-9-18-37-32;1-22-17-28(31(39)21-36-22)33-37-32-27(13-10-15-30(32)38(33)26-11-6-5-7-12-26)23-18-24(29-14-8-9-16-35-29)20-25(19-23)34(2,3)4;1-22(2)16-24-18-25(20-26(19-24)30-13-7-8-15-35-30)28-12-9-14-31-33(28)37-34(29-17-23(3)36-21-32(29)39)38(31)27-10-5-4-6-11-27;1-21(2)23-17-24(19-25(18-23)29-13-7-8-15-34-29)27-12-9-14-30-32(27)36-33(28-16-22(3)35-20-31(28)38)37(30)26-10-5-4-6-11-26;1-20-17-25(28(35)19-32-20)30-33-29-24(13-8-15-27(29)34(30)23-11-3-2-4-12-23)21-9-7-10-22(18-21)26-14-5-6-16-31-26;;;;;/h2-21,23,41H,1H3;5-17,19-21,39H,1-4H3;4-15,17-19,21-22,39H,16H2,1-3H3;4-18,20-21,38H,1-3H3;2-17,19,35H,1H3;;;;;/q5*-1;;;;;
InChIKeyJSIJNMQXKNOWOE-UHFFFAOYSA-N
MW3473.41 g/mol
LogP38.43
Rot. Bonds24

About 4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum

4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum (PubChem CID 158815353) has the molecular formula C167H131N20O5Pt5-5 and a molecular weight of 3473.41 g/mol. Its IUPAC name is 4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum.

Molecular Properties

Compound Name4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum
PubChem CID158815353
Molecular FormulaC167H131N20O5Pt5-5
Molecular Weight3473.41 g/mol
Exact Mass3470.89
IUPAC Name4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum
SMILESCc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)cc(-c5ccccc5)c4)cccc3n2-c2ccccc2)c(O)cn1.Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)cc(C(C)(C)C)c4)cccc3n2-c2ccccc2)c(O)cn1.Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)cc(C(C)C)c4)cccc3n2-c2ccccc2)c(O)cn1.Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)cc(CC(C)C)c4)cccc3n2-c2ccccc2)c(O)cn1.Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)ccc4)cccc3n2-c2ccccc2)c(O)cn1.[Pt].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/C36H25N4O.2C34H29N4O.C33H27N4O.C30H21N4O.5Pt/c1-24-19-31(34(41)23-38-24)36-39-35-30(15-10-17-33(35)40(36)29-13-6-3-7-14-29)27-20-26(25-11-4-2-5-12-25)21-28(22-27)32-16-8-9-18-37-32;1-22-17-28(31(39)21-36-22)33-37-32-27(13-10-15-30(32)38(33)26-11-6-5-7-12-26)23-18-24(29-14-8-9-16-35-29)20-25(19-23)34(2,3)4;1-22(2)16-24-18-25(20-26(19-24)30-13-7-8-15-35-30)28-12-9-14-31-33(28)37-34(29-17-23(3)36-21-32(29)39)38(31)27-10-5-4-6-11-27;1-21(2)23-17-24(19-25(18-23)29-13-7-8-15-34-29)27-12-9-14-30-32(27)36-33(28-16-22(3)35-20-31(28)38)37(30)26-10-5-4-6-11-26;1-20-17-25(28(35)19-32-20)30-33-29-24(13-8-15-27(29)34(30)23-11-3-2-4-12-23)21-9-7-10-22(18-21)26-14-5-6-16-31-26;;;;;/h2-21,23,41H,1H3;5-17,19-21,39H,1-4H3;4-15,17-19,21-22,39H,16H2,1-3H3;4-18,20-21,38H,1-3H3;2-17,19,35H,1H3;;;;;/q5*-1;;;;;
InChIKeyJSIJNMQXKNOWOE-UHFFFAOYSA-N
XLogP38.43
TPSA319.15 Ų
H-Bond Donors5
H-Bond Acceptors25
Rotatable Bonds24
Heavy Atoms197
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003473.41
LogP ≤ 538.43
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

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

Analyze 4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum?
The IUPAC name of 4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum (CID 158815353) is 4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum.
What is the SMILES notation for 4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum?
The canonical SMILES for 4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum is Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)cc(-c5ccccc5)c4)cccc3n2-c2ccccc2)c(O)cn1.Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)cc(C(C)(C)C)c4)cccc3n2-c2ccccc2)c(O)cn1.Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)cc(C(C)C)c4)cccc3n2-c2ccccc2)c(O)cn1.Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)cc(CC(C)C)c4)cccc3n2-c2ccccc2)c(O)cn1.Cc1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)ccc4)cccc3n2-c2ccccc2)c(O)cn1.[Pt].[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum?
The InChIKey is JSIJNMQXKNOWOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H25N4O.2C34H29N4O.C33H27N4O.C30H21N4O.5Pt/c1-24-19-31(34(41)23-38-24)36-39-35-30(15-10-17-33(35)40(36)29-13-6-3-7-14-29)27-20-26(25-11-4-2-5-12-25)21-28(22-27)32-16-8-9-18-37-32;1-22-17-28(31(39)21-36-22)33-37-32-27(13-10-15-30(32)38(33)26-11-6-5-7-12-26)23-18-24(29-14-8-9-16-35-29)20-25(19-23)34(2,3)4;1-22(2)16-24-18-25(20-26(19-24)30-13-7-8-15-35-30)28-12-9-14-31-33(28)37-34(29-17-23(3)36-21-32(29)39)38(31)27-10-5-4-6-11-27;1-21(2)23-17-24(19-25(18-23)29-13-7-8-15-34-29)27-12-9-14-30-32(27)36-33(28-16-22(3)35-20-31(28)38)37(30)26-10-5-4-6-11-26;1-20-17-25(28(35)19-32-20)30-33-29-24(13-8-15-27(29)34(30)23-11-3-2-4-12-23)21-9-7-10-22(18-21)26-14-5-6-16-31-26;;;;;/h2-21,23,41H,1H3;5-17,19-21,39H,1-4H3;4-15,17-19,21-22,39H,16H2,1-3H3;4-18,20-21,38H,1-3H3;2-17,19,35H,1H3;;;;;/q5*-1;;;;;.
What are the key properties of 4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum?
4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum has a molecular weight of 3473.41 g/mol, XLogP of 38.43, 24 rotatable bonds, 5 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-1-phenylbenzimidazol-2-yl]-6-methylpyridin-3-ol;6-methyl-4-[4-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;6-methyl-4-[1-phenyl-4-(3-pyridin-2-ylbenzene-2-id-1-yl)benzimidazol-2-yl]pyridin-3-ol;platinum is sourced from PubChem (CID 158815353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).