(13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+)

C53H36N4PtSSi — CID 162461410

IUPAC(13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+)
SMILESCC1(C)c2ccc([Si](c3[c-]c4c(cc3)c3ccccc3n3ccnc43)(c3ccccc3)c3ccccc3)[c-]c2N(c2ccccn2)c2ccc3sc4ccccc4c3c21.[Pt+2]
InChIInChI=1S/C53H36N4SSi.Pt/c1-53(2)43-27-25-38(34-46(43)57(49-23-13-14-30-54-49)45-28-29-48-50(51(45)53)41-20-10-12-22-47(41)58-48)59(35-15-5-3-6-16-35,36-17-7-4-8-18-36)37-24-26-39-40-19-9-11-21-44(40)56-32-31-55-52(56)42(39)33-37;/h3-32H,1-2H3;/q-2;+2
InChIKeyGLJYUCOSGWWNDP-UHFFFAOYSA-N
MW984.13 g/mol
LogP10.49
Rot. Bonds5

About (13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+)

(13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+) (PubChem CID 162461410) has the molecular formula C53H36N4PtSSi and a molecular weight of 984.13 g/mol. Its IUPAC name is (13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+).

Molecular Properties

Compound Name(13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+)
PubChem CID162461410
Molecular FormulaC53H36N4PtSSi
Molecular Weight984.13 g/mol
Exact Mass983.21
IUPAC Name(13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+)
SMILESCC1(C)c2ccc([Si](c3[c-]c4c(cc3)c3ccccc3n3ccnc43)(c3ccccc3)c3ccccc3)[c-]c2N(c2ccccn2)c2ccc3sc4ccccc4c3c21.[Pt+2]
InChIInChI=1S/C53H36N4SSi.Pt/c1-53(2)43-27-25-38(34-46(43)57(49-23-13-14-30-54-49)45-28-29-48-50(51(45)53)41-20-10-12-22-47(41)58-48)59(35-15-5-3-6-16-35,36-17-7-4-8-18-36)37-24-26-39-40-19-9-11-21-44(40)56-32-31-55-52(56)42(39)33-37;/h3-32H,1-2H3;/q-2;+2
InChIKeyGLJYUCOSGWWNDP-UHFFFAOYSA-N
XLogP10.49
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500984.13
LogP ≤ 510.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze (13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+) with MolForge

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Related Compounds

CID 162461464
CID 162461464
10-[fluoro(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)methyl]-13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzofuro[3,2-a]acridin-9-ide;platinum(2+)
CID 162461498
3-[fluoro(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)methyl]-13,13-dimethyl-8-phenyl-5-pyridin-2-yl-4H-indolo[3,2-a]acridin-4-ide;platinum(2+)
CID 162461414
[3-(14,14-dimethyl-9-oxa-19,21-diazapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaen-21-yl)benzene-2-id-1-yl]-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+)
CID 162482835
6-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)-13,13-dimethyl-8-pyridin-2-yl-7H-[1]benzofuro[3,2-a]acridin-7-ide;7-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)-13,13-dimethyl-5-pyridin-2-yl-6H-[1]benzofuro[2,3-a]acridin-6-ide;6-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)-13,13-dimethyl-8-pyridin-2-yl-7H-[1]benzothiolo[3,2-a]acridin-7-ide;7-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)-13,13-dimethyl-5-pyridin-2-yl-6H-[1]benzothiolo[2,3-a]acridin-6-ide;tetrakis(platinum(2+))
CID 162241939
10-[fluoro(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)methyl]-13,13-dimethyl-5-phenyl-8-pyridin-2-yl-9H-indolo[3,2-a]acridin-9-ide;platinum(2+)
CID 162461441
(5,5-dimethyl-13-pyridin-2-yl-[1]benzothiolo[3,2-c]acridin-2-yl)-imidazo[1,2-f]phenanthridin-11-yl-diphenylsilane
CID 140954374
(13,13-dimethyl-8-phenyl-5-pyridin-2-yl-6H-indolo[3,2-a]acridin-6-id-7-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;(13,13-dimethyl-12-phenyl-5-pyridin-2-yl-6H-indolo[2,3-a]acridin-6-id-7-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;(8,8-diphenyl-5-pyridin-2-yl-6H-[1,4]benzothiasilino[3,2-c]carbazol-6-id-7-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;(13,13-diphenyl-8-pyridin-2-yl-7H-[1,4]benzothiasilino[2,3-c]carbazol-7-id-6-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;tetrakis(platinum(2+))
CID 163879340
9-[3-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)benzene-2-id-1-yl]-14,14-dimethyl-21-phenyl-7,9,21-triazapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;9-[3-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)benzene-2-id-1-yl]-21,21-dimethyl-14-phenyl-7,9,14-triazapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;9-[3-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)benzene-2-id-1-yl]-14-thia-7,9-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;9-[3-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)benzene-2-id-1-yl]-20-thia-7,9-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaene;tetrakis(platinum(2+))
CID 160675074
12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(7-phenyl-5-pyridin-2-yl-4H-indolo[2,3-b]carbazol-4-id-3-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(11-phenyl-5-pyridin-2-yl-4H-indolo[3,2-b]carbazol-4-id-3-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(7-pyridin-2-yl-8H-[1]benzofuro[2,3-b]carbazol-8-id-9-yl)silane;12H-imidazo[1,2-f]phenanthridin-12-id-11-yl-diphenyl-(11-pyridin-2-yl-10H-[1]benzofuro[3,2-b]carbazol-10-id-9-yl)silane;tetrakis(platinum(2+))
CID 163959958
CID 162461474
CID 162461474
2-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)-5,5-dimethyl-13-pyridin-2-yl-1H-[1]benzofuro[3,2-c]acridin-1-ide;11-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)-8,8-dimethyl-13-pyridin-2-yl-12H-[1]benzofuro[2,3-c]acridin-12-ide;2-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)-5,5-dimethyl-13-pyridin-2-yl-1H-[1]benzothiolo[3,2-c]acridin-1-ide;11-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)-8,8-dimethyl-13-pyridin-2-yl-12H-[1]benzothiolo[2,3-c]acridin-12-ide;2-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)-5,5,12-triphenyl-13-pyridin-2-yl-1H-[1,4]benzazasilino[2,3-a]carbazol-1-ide;pentakis(platinum(2+))
CID 159606859

Frequently Asked Questions

What is the IUPAC name of (13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+)?
The IUPAC name of (13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+) (CID 162461410) is (13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+).
What is the SMILES notation for (13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+)?
The canonical SMILES for (13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+) is CC1(C)c2ccc([Si](c3[c-]c4c(cc3)c3ccccc3n3ccnc43)(c3ccccc3)c3ccccc3)[c-]c2N(c2ccccn2)c2ccc3sc4ccccc4c3c21.[Pt+2].
What is the InChIKey of (13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+)?
The InChIKey is GLJYUCOSGWWNDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H36N4SSi.Pt/c1-53(2)43-27-25-38(34-46(43)57(49-23-13-14-30-54-49)45-28-29-48-50(51(45)53)41-20-10-12-22-47(41)58-48)59(35-15-5-3-6-16-35,36-17-7-4-8-18-36)37-24-26-39-40-19-9-11-21-44(40)56-32-31-55-52(56)42(39)33-37;/h3-32H,1-2H3;/q-2;+2.
What are the key properties of (13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+)?
(13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+) has a molecular weight of 984.13 g/mol, XLogP of 10.49, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (13,13-dimethyl-8-pyridin-2-yl-9H-[1]benzothiolo[3,2-a]acridin-9-id-10-yl)-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)-diphenylsilane;platinum(2+) is sourced from PubChem (CID 162461410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).