platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide

C27H16N4OPt — CID 153421571

IUPACplatinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide
SMILES[Pt+2].[c-]1c(Oc2ccccn2)cncc1-c1[c-]c2c(cc1)c1ccccc1n2-c1ccccn1
InChIInChI=1S/C27H16N4O.Pt/c1-2-8-24-22(7-1)23-12-11-19(16-25(23)31(24)26-9-3-5-13-29-26)20-15-21(18-28-17-20)32-27-10-4-6-14-30-27;/h1-14,17-18H;/q-2;+2
InChIKeyAIJQTQKGCOLUGP-UHFFFAOYSA-N
MW607.53 g/mol
LogP6.03
Rot. Bonds4

About platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide

platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide (PubChem CID 153421571) has the molecular formula C27H16N4OPt and a molecular weight of 607.53 g/mol. Its IUPAC name is platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide.

Molecular Properties

Compound Nameplatinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide
PubChem CID153421571
Molecular FormulaC27H16N4OPt
Molecular Weight607.53 g/mol
Exact Mass607.10
IUPAC Nameplatinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide
SMILES[Pt+2].[c-]1c(Oc2ccccn2)cncc1-c1[c-]c2c(cc1)c1ccccc1n2-c1ccccn1
InChIInChI=1S/C27H16N4O.Pt/c1-2-8-24-22(7-1)23-12-11-19(16-25(23)31(24)26-9-3-5-13-29-26)20-15-21(18-28-17-20)32-27-10-4-6-14-30-27;/h1-14,17-18H;/q-2;+2
InChIKeyAIJQTQKGCOLUGP-UHFFFAOYSA-N
XLogP6.03
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500607.53
LogP ≤ 56.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

platinum(2+);2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-9-pyrimidin-4-yl-1H-carbazol-1-ide
CID 153421624
platinum(2+);2-(3-propan-2-yloxy-5-pyridin-2-yloxybenzene-6-id-1-yl)-9-pyridin-2-yl-1H-carbazol-1-ide
CID 153421196
2-[3-[(4,5-diethyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyridin-2-yl-1H-carbazol-1-ide;platinum(2+)
CID 153421036
2-[3-[(6-tert-butyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyridin-2-yl-1H-carbazol-1-ide;platinum(2+)
CID 153421686
platinum(2+);9-(6-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide
CID 153421244
9-(5,6-difluoro-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;platinum(2+)
CID 153421046
2-[3-[(4,6-dimethyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyridin-2-yl-1H-carbazol-1-ide;platinum(2+)
CID 153421928
5-(4-methyl-2-pyridinyl)-3-[5-[(4-methyl-2-pyridinyl)oxy]-4H-pyridin-4-id-3-yl]-4H-pyrido[3,2-b]indol-4-ide;platinum(2+)
CID 153421204
9-[5,6-di(propan-2-yl)-2-pyridinyl]-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;platinum(2+)
CID 153421270
5-carbazol-9-yl-2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)oxybenzene-2-id-1-yl]-1,3-thiazole;5-carbazol-9-yl-2-[9-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-carbazol-1-id-2-yl]-1,3-thiazole;5-carbazol-9-yl-2-[9-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-id-2-yl]-1,3-thiazole;5-carbazol-9-yl-2-[3-(2-pyridin-2-yloxy-1H-carbazol-1-id-9-yl)benzene-2-id-1-yl]-1,3-thiazole;tetrakis(platinum(2+))
CID 158191012
9-(4-deuterio-2-pyridinyl)-2-[3-[(4-deuterio-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(4-deuterio-2-pyridinyl)-2-[3-[(6-deuterio-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;9-(3,6-dideuterio-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(4,5-dideuterio-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;9-(5,6-dideuterio-2-pyridinyl)-2-(3-pyridin-2-yloxybenzene-2-id-1-yl)-1H-carbazol-1-ide;pentakis(platinum(2+))
CID 157445041
2-[3-[(3-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-9-pyridin-2-yl-1H-carbazol-1-ide;platinum(2+)
CID 153421938

Frequently Asked Questions

What is the IUPAC name of platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide?
The IUPAC name of platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide (CID 153421571) is platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide.
What is the SMILES notation for platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide?
The canonical SMILES for platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide is [Pt+2].[c-]1c(Oc2ccccn2)cncc1-c1[c-]c2c(cc1)c1ccccc1n2-c1ccccn1.
What is the InChIKey of platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide?
The InChIKey is AIJQTQKGCOLUGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H16N4O.Pt/c1-2-8-24-22(7-1)23-12-11-19(16-25(23)31(24)26-9-3-5-13-29-26)20-15-21(18-28-17-20)32-27-10-4-6-14-30-27;/h1-14,17-18H;/q-2;+2.
What are the key properties of platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide?
platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide has a molecular weight of 607.53 g/mol, XLogP of 6.03, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for platinum(2+);9-pyridin-2-yl-2-(5-pyridin-2-yloxy-4H-pyridin-4-id-3-yl)-1H-carbazol-1-ide is sourced from PubChem (CID 153421571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).