1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+))

C90H94N8OPt2 — CID 162266563

IUPAC1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+))
SMILESCC(C)c1cccc(C(C)C)c1-n1cc(-c2[c-]cccc2)nc1Oc1nc(-c2[c-]cccc2)cn1-c1c(C2CCCCC2)cccc1C1CCCCC1.Cc1cccc(C(C)C)c1-n1cc(-c2[c-]cccc2)nc1CCc1nc(-c2[c-]cccc2)cn1-c1c(C)cccc1C1CCCC1.[Pt+2].[Pt+2]
InChIInChI=1S/C48H52N4O.C42H42N4.2Pt/c1-33(2)39-27-17-28-40(34(3)4)45(39)51-31-43(37-23-13-7-14-24-37)49-47(51)53-48-50-44(38-25-15-8-16-26-38)32-52(48)46-41(35-19-9-5-10-20-35)29-18-30-42(46)36-21-11-6-12-22-36;1-29(2)35-23-13-15-30(3)41(35)45-27-37(33-19-7-5-8-20-33)43-39(45)25-26-40-44-38(34-21-9-6-10-22-34)28-46(40)42-31(4)16-14-24-36(42)32-17-11-12-18-32;;/h7-8,13-18,23,25,27-36H,5-6,9-12,19-22H2,1-4H3;5-10,13-16,19,21,23-24,27-29,32H,11-12,17-18,25-26H2,1-4H3;;/q2*-2;2*+2
InChIKeyLMMGOFQXUKPMSM-UHFFFAOYSA-N
MW1693.95 g/mol
LogP23.30
Rot. Bonds19

About 1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+))

1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+)) (PubChem CID 162266563) has the molecular formula C90H94N8OPt2 and a molecular weight of 1693.95 g/mol. Its IUPAC name is 1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+)).

Molecular Properties

Compound Name1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+))
PubChem CID162266563
Molecular FormulaC90H94N8OPt2
Molecular Weight1693.95 g/mol
Exact Mass1692.68
IUPAC Name1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+))
SMILESCC(C)c1cccc(C(C)C)c1-n1cc(-c2[c-]cccc2)nc1Oc1nc(-c2[c-]cccc2)cn1-c1c(C2CCCCC2)cccc1C1CCCCC1.Cc1cccc(C(C)C)c1-n1cc(-c2[c-]cccc2)nc1CCc1nc(-c2[c-]cccc2)cn1-c1c(C)cccc1C1CCCC1.[Pt+2].[Pt+2]
InChIInChI=1S/C48H52N4O.C42H42N4.2Pt/c1-33(2)39-27-17-28-40(34(3)4)45(39)51-31-43(37-23-13-7-14-24-37)49-47(51)53-48-50-44(38-25-15-8-16-26-38)32-52(48)46-41(35-19-9-5-10-20-35)29-18-30-42(46)36-21-11-6-12-22-36;1-29(2)35-23-13-15-30(3)41(35)45-27-37(33-19-7-5-8-20-33)43-39(45)25-26-40-44-38(34-21-9-6-10-22-34)28-46(40)42-31(4)16-14-24-36(42)32-17-11-12-18-32;;/h7-8,13-18,23,25,27-36H,5-6,9-12,19-22H2,1-4H3;5-10,13-16,19,21,23-24,27-29,32H,11-12,17-18,25-26H2,1-4H3;;/q2*-2;2*+2
InChIKeyLMMGOFQXUKPMSM-UHFFFAOYSA-N
XLogP23.30
TPSA80.51 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds19
Heavy Atoms101
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001693.95
LogP ≤ 523.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze 1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+))?
The IUPAC name of 1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+)) (CID 162266563) is 1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+)).
What is the SMILES notation for 1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+))?
The canonical SMILES for 1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+)) is CC(C)c1cccc(C(C)C)c1-n1cc(-c2[c-]cccc2)nc1Oc1nc(-c2[c-]cccc2)cn1-c1c(C2CCCCC2)cccc1C1CCCCC1.Cc1cccc(C(C)C)c1-n1cc(-c2[c-]cccc2)nc1CCc1nc(-c2[c-]cccc2)cn1-c1c(C)cccc1C1CCCC1.[Pt+2].[Pt+2].
What is the InChIKey of 1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+))?
The InChIKey is LMMGOFQXUKPMSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H52N4O.C42H42N4.2Pt/c1-33(2)39-27-17-28-40(34(3)4)45(39)51-31-43(37-23-13-7-14-24-37)49-47(51)53-48-50-44(38-25-15-8-16-26-38)32-52(48)46-41(35-19-9-5-10-20-35)29-18-30-42(46)36-21-11-6-12-22-36;1-29(2)35-23-13-15-30(3)41(35)45-27-37(33-19-7-5-8-20-33)43-39(45)25-26-40-44-38(34-21-9-6-10-22-34)28-46(40)42-31(4)16-14-24-36(42)32-17-11-12-18-32;;/h7-8,13-18,23,25,27-36H,5-6,9-12,19-22H2,1-4H3;5-10,13-16,19,21,23-24,27-29,32H,11-12,17-18,25-26H2,1-4H3;;/q2*-2;2*+2.
What are the key properties of 1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+))?
1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+)) has a molecular weight of 1693.95 g/mol, XLogP of 23.30, 19 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopentyl-6-methylphenyl)-2-[2-[1-(2-methyl-6-propan-2-ylphenyl)-4-phenylimidazol-2-yl]ethyl]-4-phenylimidazole;1-(2,6-dicyclohexylphenyl)-2-[1-[2,6-di(propan-2-yl)phenyl]-4-phenylimidazol-2-yl]oxy-4-phenylimidazole;bis(platinum(2+)) is sourced from PubChem (CID 162266563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).