15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+)

C32H18N2OPtS — CID 164939815

IUPAC15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+)
SMILES[Pt+2].[c-]1ccccc1-c1cccc(Oc2[c-]c(-c3nccc4c3sc3c5ccccc5ccc43)ccc2)n1
InChIInChI=1S/C32H18N2OS.Pt/c1-2-9-22(10-3-1)28-14-7-15-29(34-28)35-24-12-6-11-23(20-24)30-32-27(18-19-33-30)26-17-16-21-8-4-5-13-25(21)31(26)36-32;/h1-9,11-19H;/q-2;+2
InChIKeyHDOZHAHBEYBURG-UHFFFAOYSA-N
MW673.65 g/mol
LogP8.72
Rot. Bonds4

About 15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+)

15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+) (PubChem CID 164939815) has the molecular formula C32H18N2OPtS and a molecular weight of 673.65 g/mol. Its IUPAC name is 15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+).

Molecular Properties

Compound Name15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+)
PubChem CID164939815
Molecular FormulaC32H18N2OPtS
Molecular Weight673.65 g/mol
Exact Mass673.08
IUPAC Name15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+)
SMILES[Pt+2].[c-]1ccccc1-c1cccc(Oc2[c-]c(-c3nccc4c3sc3c5ccccc5ccc43)ccc2)n1
InChIInChI=1S/C32H18N2OS.Pt/c1-2-9-22(10-3-1)28-14-7-15-29(34-28)35-24-12-6-11-23(20-24)30-32-27(18-19-33-30)26-17-16-21-8-4-5-13-25(21)31(26)36-32;/h1-9,11-19H;/q-2;+2
InChIKeyHDOZHAHBEYBURG-UHFFFAOYSA-N
XLogP8.72
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500673.65
LogP ≤ 58.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+) with MolForge

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Related Compounds

CID 168721177
CID 168721177
platinum(2+);1-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)oxybenzene-2-id-1-yl]-7-tetraphenylen-2-yl-[1]benzothiolo[2,3-c]pyridine
CID 164939637
platinum(2+);1-[3-[(3-pyridin-2-yl-2H-naphthalen-2-id-1-yl)oxy]benzene-2-id-1-yl]isoquinoline
CID 153429196
2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum
CID 166562222
iridium(3+);1-phenylisoquinoline;bis(2-phenylpyridine)
CID 140815692
15-[4-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxy-5-methyl-3H-thiophen-3-id-2-yl]-5-(2,2-dimethylpropyl)-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+)
CID 171724960
(1Z,3Z)-1-[(6-phenyl-2-pyridinyl)methylidene]-3-(pyridin-2-ylmethylidene)isoindol-2-ide;platinum(2+)
CID 155601727
chloronickel;2,6-di(phenyl)pyridine
CID 153499161
1-(9,10-diphenyl-3H-anthracen-3-id-2-yl)naphtho[2,1-f]isoquinoline;iridium;2-phenylpyridine
CID 176775848
CID 165170383
CID 165170383
iridium;4-(3-methylbenzene-6-id-1-yl)benzo[f]isoquinoline;4-methyl-2-phenylpyridine
CID 162470285
6'-[6-[3-phenyl-5-(2,2,6,6-tetramethylcyclohexyl)benzene-2-id-1-yl]oxy-2-pyridinyl]spiro[1,3-dihydroindene-2,13'-8-oxa-5-azatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2(7),3,5,10,15-hexaene];platinum(2+)
CID 164727573

Frequently Asked Questions

What is the IUPAC name of 15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+)?
The IUPAC name of 15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+) (CID 164939815) is 15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+).
What is the SMILES notation for 15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+)?
The canonical SMILES for 15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+) is [Pt+2].[c-]1ccccc1-c1cccc(Oc2[c-]c(-c3nccc4c3sc3c5ccccc5ccc43)ccc2)n1.
What is the InChIKey of 15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+)?
The InChIKey is HDOZHAHBEYBURG-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H18N2OS.Pt/c1-2-9-22(10-3-1)28-14-7-15-29(34-28)35-24-12-6-11-23(20-24)30-32-27(18-19-33-30)26-17-16-21-8-4-5-13-25(21)31(26)36-32;/h1-9,11-19H;/q-2;+2.
What are the key properties of 15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+)?
15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+) has a molecular weight of 673.65 g/mol, XLogP of 8.72, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+) is sourced from PubChem (CID 164939815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).