2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))

C141H75N19O11Pt4 — CID 157332491

IUPAC2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-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(-c2ccc(-c3ncco3)cn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2cc(-c3ncco3)ccc21.[c-]1c(-c2cccc(-c3ncco3)n2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2ccccc21.[c-]1c(-c2ccccn2)ccc(-c2ncco2)c1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2cc(-c3ncco3)ccc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)c(-c3ncco3)cc2c2cc(-c3ncco3)ccc21
InChIInChI=1S/3C36H19N5O3.C33H18N4O2.4Pt/c1-2-10-33-30(9-1)40-36(44-33)28-21-32-26(20-27(28)35-39-15-17-43-35)25-19-23(34-38-14-16-42-34)11-12-31(25)41(32)24-7-5-6-22(18-24)29-8-3-4-13-37-29;1-2-7-33-29(6-1)40-35(44-33)24-9-11-25-27-19-23(34-38-15-17-42-34)10-13-30(27)41(31(25)21-24)32-20-22(28-5-3-4-14-37-28)8-12-26(32)36-39-16-18-43-36;1-2-7-33-30(6-1)40-36(44-33)24-8-11-27-28-19-23(34-37-14-16-42-34)10-13-31(28)41(32(27)20-24)26-5-3-4-22(18-26)29-12-9-25(21-39-29)35-38-15-17-43-35;1-3-13-29-24(9-1)25-16-15-22(32-36-27-10-2-4-14-31(27)39-32)20-30(25)37(29)23-8-5-7-21(19-23)26-11-6-12-28(35-26)33-34-17-18-38-33;;;;/h1-17,19-20H;1-19H;1-17,19,21H;1-18H;;;;/q4*-2;4*+2
InChIKeyMBIAJLHLAISKLU-UHFFFAOYSA-N
MW2991.58 g/mol
LogP33.59
Rot. Bonds19

About 2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))

2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)) (PubChem CID 157332491) has the molecular formula C141H75N19O11Pt4 and a molecular weight of 2991.58 g/mol. Its IUPAC name is 2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)).

Molecular Properties

Compound Name2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))
PubChem CID157332491
Molecular FormulaC141H75N19O11Pt4
Molecular Weight2991.58 g/mol
Exact Mass2989.45
IUPAC Name2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-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(-c2ccc(-c3ncco3)cn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2cc(-c3ncco3)ccc21.[c-]1c(-c2cccc(-c3ncco3)n2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2ccccc21.[c-]1c(-c2ccccn2)ccc(-c2ncco2)c1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2cc(-c3ncco3)ccc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)c(-c3ncco3)cc2c2cc(-c3ncco3)ccc21
InChIInChI=1S/3C36H19N5O3.C33H18N4O2.4Pt/c1-2-10-33-30(9-1)40-36(44-33)28-21-32-26(20-27(28)35-39-15-17-43-35)25-19-23(34-38-14-16-42-34)11-12-31(25)41(32)24-7-5-6-22(18-24)29-8-3-4-13-37-29;1-2-7-33-29(6-1)40-35(44-33)24-9-11-25-27-19-23(34-38-15-17-42-34)10-13-30(27)41(31(25)21-24)32-20-22(28-5-3-4-14-37-28)8-12-26(32)36-39-16-18-43-36;1-2-7-33-30(6-1)40-36(44-33)24-8-11-27-28-19-23(34-37-14-16-42-34)10-13-31(28)41(32(27)20-24)26-5-3-4-22(18-26)29-12-9-25(21-39-29)35-38-15-17-43-35;1-3-13-29-24(9-1)25-16-15-22(32-36-27-10-2-4-14-31(27)39-32)20-30(25)37(29)23-8-5-7-21(19-23)26-11-6-12-28(35-26)33-34-17-18-38-33;;;;/h1-17,19-20H;1-19H;1-17,19,21H;1-18H;;;;/q4*-2;4*+2
InChIKeyMBIAJLHLAISKLU-UHFFFAOYSA-N
XLogP33.59
TPSA357.61 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds19
Heavy Atoms175
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002991.58
LogP ≤ 533.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

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

Analyze 2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-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-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))?
The IUPAC name of 2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)) (CID 157332491) is 2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)).
What is the SMILES notation for 2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))?
The canonical SMILES for 2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-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(-c2ccc(-c3ncco3)cn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2cc(-c3ncco3)ccc21.[c-]1c(-c2cccc(-c3ncco3)n2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2ccccc21.[c-]1c(-c2ccccn2)ccc(-c2ncco2)c1-n1c2[c-]c(-c3nc4ccccc4o3)ccc2c2cc(-c3ncco3)ccc21.[c-]1c(-c2ccccn2)cccc1-n1c2[c-]c(-c3nc4ccccc4o3)c(-c3ncco3)cc2c2cc(-c3ncco3)ccc21.
What is the InChIKey of 2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))?
The InChIKey is MBIAJLHLAISKLU-UHFFFAOYSA-N. The full InChI is InChI=1S/3C36H19N5O3.C33H18N4O2.4Pt/c1-2-10-33-30(9-1)40-36(44-33)28-21-32-26(20-27(28)35-39-15-17-43-35)25-19-23(34-38-14-16-42-34)11-12-31(25)41(32)24-7-5-6-22(18-24)29-8-3-4-13-37-29;1-2-7-33-29(6-1)40-35(44-33)24-9-11-25-27-19-23(34-38-15-17-42-34)10-13-30(27)41(31(25)21-24)32-20-22(28-5-3-4-14-37-28)8-12-26(32)36-39-16-18-43-36;1-2-7-33-30(6-1)40-36(44-33)24-8-11-27-28-19-23(34-37-14-16-42-34)10-13-31(28)41(32(27)20-24)26-5-3-4-22(18-26)29-12-9-25(21-39-29)35-38-15-17-43-35;1-3-13-29-24(9-1)25-16-15-22(32-36-27-10-2-4-14-31(27)39-32)20-30(25)37(29)23-8-5-7-21(19-23)26-11-6-12-28(35-26)33-34-17-18-38-33;;;;/h1-17,19-20H;1-19H;1-17,19,21H;1-18H;;;;/q4*-2;4*+2.
What are the key properties of 2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+))?
2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)) has a molecular weight of 2991.58 g/mol, XLogP of 33.59, 19 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,6-bis(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[2-(1,3-oxazol-2-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[6-(1,3-oxazol-2-yl)-9-[3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;2-[9-[3-[6-(1,3-oxazol-2-yl)-2-pyridinyl]benzene-2-id-1-yl]-1H-carbazol-1-id-2-yl]-1,3-benzoxazole;tetrakis(platinum(2+)) is sourced from PubChem (CID 157332491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).