7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum

About 7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum

7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (PubChem CID 162448300) has the molecular formula C68H63N4OPt-3 and a molecular weight of 1147.36 g/mol. Its IUPAC name is 7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

Molecular Properties

Compound Name	7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
PubChem CID	162448300
Molecular Formula	C68H63N4OPt-3
Molecular Weight	1147.36 g/mol
Exact Mass	1146.47
IUPAC Name	7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
SMILES	CC(C)(C)c1ccc2c(c1)N(c1cc(-c3ccccc3)cc(C(C)(C)c3ccccc3)c1)[CH-]N2c1[c-]c(Oc2[c-]c3c(cc2)c2ccc(C(C)(C)C)cc2n3-c2cc(C(C)(C)c3ccccc3)ccn2)ccc1.[Pt]
InChI	InChI=1S/C68H63N4O.Pt/c1-65(2,3)50-29-32-58-59-33-31-57(44-62(59)72(61(58)40-50)64-42-52(35-36-69-64)67(7,8)48-23-16-12-17-24-48)73-56-28-20-27-54(43-56)70-45-71(63-41-51(66(4,5)6)30-34-60(63)70)55-38-47(46-21-14-11-15-22-46)37-53(39-55)68(9,10)49-25-18-13-19-26-49;/h11-42,45H,1-10H3;/q-3;
InChIKey	SCDQHWLELSYOML-UHFFFAOYSA-N
XLogP	17.89
TPSA	33.53 Å²
H-Bond Donors
H-Bond Acceptors	5
Rotatable Bonds	10
Heavy Atoms	74
Complexity	—

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1147.36
LogP ≤ 5	17.89
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The IUPAC name of 7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (CID 162448300) is 7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The canonical SMILES for 7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is CC(C)(C)c1ccc2c(c1)N(c1cc(-c3ccccc3)cc(C(C)(C)c3ccccc3)c1)[CH-]N2c1[c-]c(Oc2[c-]c3c(cc2)c2ccc(C(C)(C)C)cc2n3-c2cc(C(C)(C)c3ccccc3)ccn2)ccc1.[Pt].

What is the InChIKey of 7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The InChIKey is SCDQHWLELSYOML-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H63N4O.Pt/c1-65(2,3)50-29-32-58-59-33-31-57(44-62(59)72(61(58)40-50)64-42-52(35-36-69-64)67(7,8)48-23-16-12-17-24-48)73-56-28-20-27-54(43-56)70-45-71(63-41-51(66(4,5)6)30-34-60(63)70)55-38-47(46-21-14-11-15-22-46)37-53(39-55)68(9,10)49-25-18-13-19-26-49;/h11-42,45H,1-10H3;/q-3;.

What are the key properties of 7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum has a molecular weight of 1147.36 g/mol, XLogP of 17.89, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 7-tert-butyl-2-[3-[5-tert-butyl-3-[3-phenyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162448300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).