2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum

C183H178N16O4Pt4-4 — CID 159445809

IUPAC2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum
SMILESCC(C)(C)c1cc(-c2ccccn2)[c-]c(-c2cncc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccccc2-c2ccccc2)c1.CC(C)(C)c1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)ccc4)cncc3n2-c2ccccc2-c2ccccc2)c(O)c(C(C)(C)C)c1.CC(C)Cc1cc(-c2ccccn2)[c-]c(-c2cncc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccccc2-c2ccccc2)c1.CC(C)c1cc(-c2ccccn2)[c-]c(-c2cncc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccccc2-c2ccccc2)c1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C47H47N4O.C46H45N4O.C43H39N4O.4Pt/c1-45(2,3)33-24-31(23-32(25-33)39-20-15-16-22-49-39)37-28-48-29-41-42(37)50-44(36-26-34(46(4,5)6)27-38(43(36)52)47(7,8)9)51(41)40-21-14-13-19-35(40)30-17-11-10-12-18-30;1-30(2)22-31-23-33(25-34(24-31)40-19-14-15-21-49-40)38-28-48-29-42-43(38)50-45(37-26-35(46(3,4)5)27-39(44(37)52)47(6,7)8)51(42)41-20-13-12-18-36(41)32-16-10-9-11-17-32;1-29(2)31-22-32(24-33(23-31)39-19-14-15-21-48-39)37-27-47-28-41-42(37)49-44(36-25-34(45(3,4)5)26-38(43(36)51)46(6,7)8)50(41)40-20-13-12-18-35(40)30-16-10-9-11-17-30;1-42(2,3)31-24-33(40(48)35(25-31)43(4,5)6)41-46-39-34(29-17-14-18-30(23-29)36-20-12-13-22-45-36)26-44-27-38(39)47(41)37-21-11-10-19-32(37)28-15-8-7-9-16-28;;;;/h10-22,24-29,52H,1-9H3;9-21,23-24,26-30,52H,22H2,1-8H3;9-23,25-29,51H,1-8H3;7-22,24-27,48H,1-6H3;;;;/q4*-1;;;;
InChIKeyHNTIQASVPABVNB-UHFFFAOYSA-N
MW3445.86 g/mol
LogP45.95
Rot. Bonds23

About 2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum

2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum (PubChem CID 159445809) has the molecular formula C183H178N16O4Pt4-4 and a molecular weight of 3445.86 g/mol. Its IUPAC name is 2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum.

Molecular Properties

Compound Name2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum
PubChem CID159445809
Molecular FormulaC183H178N16O4Pt4-4
Molecular Weight3445.86 g/mol
Exact Mass3443.28
IUPAC Name2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum
SMILESCC(C)(C)c1cc(-c2ccccn2)[c-]c(-c2cncc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccccc2-c2ccccc2)c1.CC(C)(C)c1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)ccc4)cncc3n2-c2ccccc2-c2ccccc2)c(O)c(C(C)(C)C)c1.CC(C)Cc1cc(-c2ccccn2)[c-]c(-c2cncc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccccc2-c2ccccc2)c1.CC(C)c1cc(-c2ccccn2)[c-]c(-c2cncc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccccc2-c2ccccc2)c1.[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C47H47N4O.C46H45N4O.C43H39N4O.4Pt/c1-45(2,3)33-24-31(23-32(25-33)39-20-15-16-22-49-39)37-28-48-29-41-42(37)50-44(36-26-34(46(4,5)6)27-38(43(36)52)47(7,8)9)51(41)40-21-14-13-19-35(40)30-17-11-10-12-18-30;1-30(2)22-31-23-33(25-34(24-31)40-19-14-15-21-49-40)38-28-48-29-42-43(38)50-45(37-26-35(46(3,4)5)27-39(44(37)52)47(6,7)8)51(42)41-20-13-12-18-36(41)32-16-10-9-11-17-32;1-29(2)31-22-32(24-33(23-31)39-19-14-15-21-48-39)37-27-47-28-41-42(37)49-44(36-25-34(45(3,4)5)26-38(43(36)51)46(6,7)8)50(41)40-20-13-12-18-35(40)30-16-10-9-11-17-30;1-42(2,3)31-24-33(40(48)35(25-31)43(4,5)6)41-46-39-34(29-17-14-18-30(23-29)36-20-12-13-22-45-36)26-44-27-38(39)47(41)37-21-11-10-19-32(37)28-15-8-7-9-16-28;;;;/h10-22,24-29,52H,1-9H3;9-21,23-24,26-30,52H,22H2,1-8H3;9-23,25-29,51H,1-8H3;7-22,24-27,48H,1-6H3;;;;/q4*-1;;;;
InChIKeyHNTIQASVPABVNB-UHFFFAOYSA-N
XLogP45.95
TPSA255.32 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds23
Heavy Atoms207
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003445.86
LogP ≤ 545.95
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze 2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum?
The IUPAC name of 2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum (CID 159445809) is 2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum.
What is the SMILES notation for 2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum?
The canonical SMILES for 2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum is CC(C)(C)c1cc(-c2ccccn2)[c-]c(-c2cncc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccccc2-c2ccccc2)c1.CC(C)(C)c1cc(-c2nc3c(-c4[c-]c(-c5ccccn5)ccc4)cncc3n2-c2ccccc2-c2ccccc2)c(O)c(C(C)(C)C)c1.CC(C)Cc1cc(-c2ccccn2)[c-]c(-c2cncc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccccc2-c2ccccc2)c1.CC(C)c1cc(-c2ccccn2)[c-]c(-c2cncc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccccc2-c2ccccc2)c1.[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum?
The InChIKey is HNTIQASVPABVNB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C47H47N4O.C46H45N4O.C43H39N4O.4Pt/c1-45(2,3)33-24-31(23-32(25-33)39-20-15-16-22-49-39)37-28-48-29-41-42(37)50-44(36-26-34(46(4,5)6)27-38(43(36)52)47(7,8)9)51(41)40-21-14-13-19-35(40)30-17-11-10-12-18-30;1-30(2)22-31-23-33(25-34(24-31)40-19-14-15-21-49-40)38-28-48-29-42-43(38)50-45(37-26-35(46(3,4)5)27-39(44(37)52)47(6,7)8)51(42)41-20-13-12-18-36(41)32-16-10-9-11-17-32;1-29(2)31-22-32(24-33(23-31)39-19-14-15-21-48-39)37-27-47-28-41-42(37)49-44(36-25-34(45(3,4)5)26-38(43(36)51)46(6,7)8)50(41)40-20-13-12-18-35(40)30-16-10-9-11-17-30;1-42(2,3)31-24-33(40(48)35(25-31)43(4,5)6)41-46-39-34(29-17-14-18-30(23-29)36-20-12-13-22-45-36)26-44-27-38(39)47(41)37-21-11-10-19-32(37)28-15-8-7-9-16-28;;;;/h10-22,24-29,52H,1-9H3;9-21,23-24,26-30,52H,22H2,1-8H3;9-23,25-29,51H,1-8H3;7-22,24-27,48H,1-6H3;;;;/q4*-1;;;;.
What are the key properties of 2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum?
2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum has a molecular weight of 3445.86 g/mol, XLogP of 45.95, 23 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-ditert-butyl-6-[7-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[7-[3-(2-methylpropyl)-5-pyridin-2-ylbenzene-6-id-1-yl]-3-(2-phenylphenyl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-propan-2-yl-5-pyridin-2-ylbenzene-6-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;2,4-ditert-butyl-6-[3-(2-phenylphenyl)-7-(3-pyridin-2-ylbenzene-2-id-1-yl)imidazo[4,5-c]pyridin-2-yl]phenol;platinum is sourced from PubChem (CID 159445809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).