2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))

C168H100N12O4Pt4 — CID 157273570

IUPAC2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))
SMILES[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2c(-c3ccc(-c4ccccc4)cc3)cccc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2cc(-c3ccc(-c4ccccc4)cc3)ccc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2ccc(-c3ccc(-c4ccccc4)cc3)cc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2cccc(-c3ccc(-c4ccccc4)cc3)c21
InChIInChI=1S/4C42H25N3O.4Pt/c1-2-10-28(11-3-1)29-19-21-30(22-20-29)34-14-9-15-36-35-24-23-32(42-44-38-17-4-5-18-40(38)46-42)27-39(35)45(41(34)36)33-13-8-12-31(26-33)37-16-6-7-25-43-37;1-2-10-28(11-3-1)29-19-21-30(22-20-29)34-14-9-17-38-41(34)35-24-23-32(42-44-37-16-4-5-18-40(37)46-42)27-39(35)45(38)33-13-8-12-31(26-33)36-15-6-7-25-43-36;1-2-9-28(10-3-1)29-16-18-30(19-17-29)31-21-23-39-36(26-31)35-22-20-33(42-44-38-14-4-5-15-41(38)46-42)27-40(35)45(39)34-12-8-11-32(25-34)37-13-6-7-24-43-37;1-2-9-28(10-3-1)29-16-18-30(19-17-29)31-20-22-35-36-23-21-33(42-44-38-14-4-5-15-41(38)46-42)27-40(36)45(39(35)26-31)34-12-8-11-32(25-34)37-13-6-7-24-43-37;;;;/h2*1-25H;2*1-24,26H;;;;/q4*-2;4*+2
InChIKeyWGDRAQXTRHRMSN-UHFFFAOYSA-N
MW3131.04 g/mol
LogP42.34
Rot. Bonds20

About 2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))

2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)) (PubChem CID 157273570) has the molecular formula C168H100N12O4Pt4 and a molecular weight of 3131.04 g/mol. Its IUPAC name is 2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)).

Molecular Properties

Compound Name2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))
PubChem CID157273570
Molecular FormulaC168H100N12O4Pt4
Molecular Weight3131.04 g/mol
Exact Mass3128.66
IUPAC Name2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))
SMILES[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2c(-c3ccc(-c4ccccc4)cc3)cccc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2cc(-c3ccc(-c4ccccc4)cc3)ccc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2ccc(-c3ccc(-c4ccccc4)cc3)cc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2cccc(-c3ccc(-c4ccccc4)cc3)c21
InChIInChI=1S/4C42H25N3O.4Pt/c1-2-10-28(11-3-1)29-19-21-30(22-20-29)34-14-9-15-36-35-24-23-32(42-44-38-17-4-5-18-40(38)46-42)27-39(35)45(41(34)36)33-13-8-12-31(26-33)37-16-6-7-25-43-37;1-2-10-28(11-3-1)29-19-21-30(22-20-29)34-14-9-17-38-41(34)35-24-23-32(42-44-37-16-4-5-18-40(37)46-42)27-39(35)45(38)33-13-8-12-31(26-33)36-15-6-7-25-43-36;1-2-9-28(10-3-1)29-16-18-30(19-17-29)31-21-23-39-36(26-31)35-22-20-33(42-44-38-14-4-5-15-41(38)46-42)27-40(35)45(39)34-12-8-11-32(25-34)37-13-6-7-24-43-37;1-2-9-28(10-3-1)29-16-18-30(19-17-29)31-20-22-35-36-23-21-33(42-44-38-14-4-5-15-41(38)46-42)27-40(36)45(39(35)26-31)34-12-8-11-32(25-34)37-13-6-7-24-43-37;;;;/h2*1-25H;2*1-24,26H;;;;/q4*-2;4*+2
InChIKeyWGDRAQXTRHRMSN-UHFFFAOYSA-N
XLogP42.34
TPSA175.40 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds20
Heavy Atoms188
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003131.04
LogP ≤ 542.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))?
The IUPAC name of 2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)) (CID 157273570) is 2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)).
What is the SMILES notation for 2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))?
The canonical SMILES for 2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)) is [Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2c(-c3ccc(-c4ccccc4)cc3)cccc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2cc(-c3ccc(-c4ccccc4)cc3)ccc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2ccc(-c3ccc(-c4ccccc4)cc3)cc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2cccc(-c3ccc(-c4ccccc4)cc3)c21.
What is the InChIKey of 2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))?
The InChIKey is WGDRAQXTRHRMSN-UHFFFAOYSA-N. The full InChI is InChI=1S/4C42H25N3O.4Pt/c1-2-10-28(11-3-1)29-19-21-30(22-20-29)34-14-9-15-36-35-24-23-32(42-44-38-17-4-5-18-40(38)46-42)27-39(35)45(41(34)36)33-13-8-12-31(26-33)37-16-6-7-25-43-37;1-2-10-28(11-3-1)29-19-21-30(22-20-29)34-14-9-17-38-41(34)35-24-23-32(42-44-37-16-4-5-18-40(37)46-42)27-39(35)45(38)33-13-8-12-31(26-33)36-15-6-7-25-43-36;1-2-9-28(10-3-1)29-16-18-30(19-17-29)31-21-23-39-36(26-31)35-22-20-33(42-44-38-14-4-5-15-41(38)46-42)27-40(35)45(39)34-12-8-11-32(25-34)37-13-6-7-24-43-37;1-2-9-28(10-3-1)29-16-18-30(19-17-29)31-20-22-35-36-23-21-33(42-44-38-14-4-5-15-41(38)46-42)27-40(36)45(39(35)26-31)34-12-8-11-32(25-34)37-13-6-7-24-43-37;;;;/h2*1-25H;2*1-24,26H;;;;/q4*-2;4*+2.
What are the key properties of 2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))?
2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)) has a molecular weight of 3131.04 g/mol, XLogP of 42.34, 20 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[7-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[8-(4-phenylphenyl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)) is sourced from PubChem (CID 157273570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).