[3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+))

C170H114B3N15OPt4Si — CID 157108917

IUPAC[3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+))
SMILESCC(C)c1cccc(C(C)C)c1-c1cnc2c3[c-]c(B(c4[c-]c5c(cc4)c4ccccc4n5-c4ccccn4)c4ccccc4)ccc3c3ccccc3n12.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(B(c2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)c2ccccc2)ccc2c1c1ncc(-c3ccccc3)n1c1ccccc21.[c-]1c(Oc2ccccn2)cccc1B(c1[c-]c2c(cc1)c1ccccc1n1ccnc21)c1ccccc1.[c-]1c([Si](c2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)(c2ccccc2)c2ccccc2)ccc2c1c1nccn1c1ccccc21
InChIInChI=1S/C50H39BN4.C44H27BN4.C44H28N4Si.C32H20BN3O.4Pt/c1-32(2)37-19-14-20-38(33(3)4)49(37)47-31-53-50-43-29-35(24-26-39(43)40-17-8-11-22-45(40)55(47)50)51(34-15-6-5-7-16-34)36-25-27-42-41-18-9-10-21-44(41)54(46(42)30-36)48-23-12-13-28-52-48;1-3-13-30(14-4-1)42-29-47-44-38-27-32(22-24-34(38)35-17-7-10-20-40(35)49(42)44)45(31-15-5-2-6-16-31)33-23-25-37-36-18-8-9-19-39(36)48(41(37)28-33)43-21-11-12-26-46-43;1-3-13-31(14-4-1)49(32-15-5-2-6-16-32,33-22-24-35-36-17-7-9-19-40(36)47-28-27-46-44(47)39(35)29-33)34-23-25-38-37-18-8-10-20-41(37)48(42(38)30-34)43-21-11-12-26-45-43;1-2-9-23(10-3-1)33(24-11-8-12-26(21-24)37-31-15-6-7-18-34-31)25-16-17-27-28-13-4-5-14-30(28)36-20-19-35-32(36)29(27)22-25;;;;/h5-28,31-33H,1-4H3;1-26,29H;1-28H;1-20H;;;;/q4*-2;4*+2
InChIKeyYLTQMJVVNONBOO-UHFFFAOYSA-N
MW3223.72 g/mol
LogP30.12
Rot. Bonds22

About [3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+))

[3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+)) (PubChem CID 157108917) has the molecular formula C170H114B3N15OPt4Si and a molecular weight of 3223.72 g/mol. Its IUPAC name is [3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+)).

Molecular Properties

Compound Name[3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+))
PubChem CID157108917
Molecular FormulaC170H114B3N15OPt4Si
Molecular Weight3223.72 g/mol
Exact Mass3221.80
IUPAC Name[3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+))
SMILESCC(C)c1cccc(C(C)C)c1-c1cnc2c3[c-]c(B(c4[c-]c5c(cc4)c4ccccc4n5-c4ccccn4)c4ccccc4)ccc3c3ccccc3n12.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(B(c2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)c2ccccc2)ccc2c1c1ncc(-c3ccccc3)n1c1ccccc21.[c-]1c(Oc2ccccn2)cccc1B(c1[c-]c2c(cc1)c1ccccc1n1ccnc21)c1ccccc1.[c-]1c([Si](c2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)(c2ccccc2)c2ccccc2)ccc2c1c1nccn1c1ccccc21
InChIInChI=1S/C50H39BN4.C44H27BN4.C44H28N4Si.C32H20BN3O.4Pt/c1-32(2)37-19-14-20-38(33(3)4)49(37)47-31-53-50-43-29-35(24-26-39(43)40-17-8-11-22-45(40)55(47)50)51(34-15-6-5-7-16-34)36-25-27-42-41-18-9-10-21-44(41)54(46(42)30-36)48-23-12-13-28-52-48;1-3-13-30(14-4-1)42-29-47-44-38-27-32(22-24-34(38)35-17-7-10-20-40(35)49(42)44)45(31-15-5-2-6-16-31)33-23-25-37-36-18-8-9-19-39(36)48(41(37)28-33)43-21-11-12-26-46-43;1-3-13-31(14-4-1)49(32-15-5-2-6-16-32,33-22-24-35-36-17-7-9-19-40(36)47-28-27-46-44(47)39(35)29-33)34-23-25-38-37-18-8-10-20-41(37)48(42(38)30-34)43-21-11-12-26-45-43;1-2-9-23(10-3-1)33(24-11-8-12-26(21-24)37-31-15-6-7-18-34-31)25-16-17-27-28-13-4-5-14-30(28)36-20-19-35-32(36)29(27)22-25;;;;/h5-28,31-33H,1-4H3;1-26,29H;1-28H;1-20H;;;;/q4*-2;4*+2
InChIKeyYLTQMJVVNONBOO-UHFFFAOYSA-N
XLogP30.12
TPSA144.78 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds22
Heavy Atoms194
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003223.72
LogP ≤ 530.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze [3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of [3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+))?
The IUPAC name of [3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+)) (CID 157108917) is [3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+)).
What is the SMILES notation for [3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+))?
The canonical SMILES for [3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+)) is CC(C)c1cccc(C(C)C)c1-c1cnc2c3[c-]c(B(c4[c-]c5c(cc4)c4ccccc4n5-c4ccccn4)c4ccccc4)ccc3c3ccccc3n12.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(B(c2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)c2ccccc2)ccc2c1c1ncc(-c3ccccc3)n1c1ccccc21.[c-]1c(Oc2ccccn2)cccc1B(c1[c-]c2c(cc1)c1ccccc1n1ccnc21)c1ccccc1.[c-]1c([Si](c2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)(c2ccccc2)c2ccccc2)ccc2c1c1nccn1c1ccccc21.
What is the InChIKey of [3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+))?
The InChIKey is YLTQMJVVNONBOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H39BN4.C44H27BN4.C44H28N4Si.C32H20BN3O.4Pt/c1-32(2)37-19-14-20-38(33(3)4)49(37)47-31-53-50-43-29-35(24-26-39(43)40-17-8-11-22-45(40)55(47)50)51(34-15-6-5-7-16-34)36-25-27-42-41-18-9-10-21-44(41)54(46(42)30-36)48-23-12-13-28-52-48;1-3-13-30(14-4-1)42-29-47-44-38-27-32(22-24-34(38)35-17-7-10-20-40(35)49(42)44)45(31-15-5-2-6-16-31)33-23-25-37-36-18-8-9-19-39(36)48(41(37)28-33)43-21-11-12-26-46-43;1-3-13-31(14-4-1)49(32-15-5-2-6-16-32,33-22-24-35-36-17-7-9-19-40(36)47-28-27-46-44(47)39(35)29-33)34-23-25-38-37-18-8-10-20-41(37)48(42(38)30-34)43-21-11-12-26-45-43;1-2-9-23(10-3-1)33(24-11-8-12-26(21-24)37-31-15-6-7-18-34-31)25-16-17-27-28-13-4-5-14-30(28)36-20-19-35-32(36)29(27)22-25;;;;/h5-28,31-33H,1-4H3;1-26,29H;1-28H;1-20H;;;;/q4*-2;4*+2.
What are the key properties of [3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+))?
[3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+)) has a molecular weight of 3223.72 g/mol, XLogP of 30.12, 22 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[2,6-di(propan-2-yl)phenyl]-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl]-phenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;phenyl-(3-phenyl-12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)borane;tetrakis(platinum(2+)) is sourced from PubChem (CID 157108917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).