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+)

C48H32FN5Pt — CID 162461441

IUPAC10-[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+)
SMILESCC1(C)c2ccccc2N(c2ccccc2)c2ccc3c(c21)c1ccc(C(F)c2[c-]c4c(cc2)c2ccccc2n2ccnc42)[c-]c1n3-c1ccccn1.[Pt+2]
InChIInChI=1S/C48H32FN5.Pt/c1-48(2)37-15-7-9-17-39(37)53(32-12-4-3-5-13-32)41-24-23-40-44(45(41)48)35-22-20-31(29-42(35)54(40)43-18-10-11-25-50-43)46(49)30-19-21-33-34-14-6-8-16-38(34)52-27-26-51-47(52)36(33)28-30;/h3-27,46H,1-2H3;/q-2;+2
InChIKeyRKEJLSSQAAFZHF-UHFFFAOYSA-N
MW892.90 g/mol
LogP11.90
Rot. Bonds4

About 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+)

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+) (PubChem CID 162461441) has the molecular formula C48H32FN5Pt and a molecular weight of 892.90 g/mol. Its IUPAC name is 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+).

Molecular Properties

Compound Name10-[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+)
PubChem CID162461441
Molecular FormulaC48H32FN5Pt
Molecular Weight892.90 g/mol
Exact Mass892.23
IUPAC Name10-[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+)
SMILESCC1(C)c2ccccc2N(c2ccccc2)c2ccc3c(c21)c1ccc(C(F)c2[c-]c4c(cc2)c2ccccc2n2ccnc42)[c-]c1n3-c1ccccn1.[Pt+2]
InChIInChI=1S/C48H32FN5.Pt/c1-48(2)37-15-7-9-17-39(37)53(32-12-4-3-5-13-32)41-24-23-40-44(45(41)48)35-22-20-31(29-42(35)54(40)43-18-10-11-25-50-43)46(49)30-19-21-33-34-14-6-8-16-38(34)52-27-26-51-47(52)36(33)28-30;/h3-27,46H,1-2H3;/q-2;+2
InChIKeyRKEJLSSQAAFZHF-UHFFFAOYSA-N
XLogP11.90
TPSA38.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500892.90
LogP ≤ 511.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 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+) with MolForge

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Related Compounds

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-[3-[fluoro(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)methyl]benzene-2-id-1-yl]-21,21-dimethyl-14-phenyl-3,5,14-triazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),2(10),4(9),5,7,11,15,17,19-nonaene;platinum(2+)
CID 162482815
3-[fluoro(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)methyl]-5-pyridin-2-yl-4H-[1]benzofuro[3,2-c]carbazol-4-ide;platinum(2+)
CID 162461468
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
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
(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
6-[fluoro(imidazo[1,2-f]phenanthridin-11-yl)methyl]-13,13-dimethyl-8-pyridin-2-yl-[1]benzofuro[3,2-a]acridine
CID 140955640
3-[3-(12H-imidazo[1,2-f]phenanthridin-12-id-11-yloxy)benzene-2-id-1-yl]-14,14-dimethyl-21-phenyl-3,5,21-triazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),2(10),4(9),5,7,11,15,17,19-nonaene;platinum(2+)
CID 162483158
3-[3-[fluoro(12H-imidazo[1,2-f]phenanthridin-12-id-11-yl)methyl]benzene-2-id-1-yl]-14,14-dimethyl-21-thia-3,5-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),2(10),4(9),5,7,11,15,17,19-nonaene;platinum(2+)
CID 162482836
CID 162487067
CID 162487067
CID 157162947
CID 157162947
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

Frequently Asked Questions

What is the IUPAC name of 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+)?
The IUPAC name of 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) is 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+).
What is the SMILES notation for 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+)?
The canonical SMILES for 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+) is CC1(C)c2ccccc2N(c2ccccc2)c2ccc3c(c21)c1ccc(C(F)c2[c-]c4c(cc2)c2ccccc2n2ccnc42)[c-]c1n3-c1ccccn1.[Pt+2].
What is the InChIKey of 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+)?
The InChIKey is RKEJLSSQAAFZHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32FN5.Pt/c1-48(2)37-15-7-9-17-39(37)53(32-12-4-3-5-13-32)41-24-23-40-44(45(41)48)35-22-20-31(29-42(35)54(40)43-18-10-11-25-50-43)46(49)30-19-21-33-34-14-6-8-16-38(34)52-27-26-51-47(52)36(33)28-30;/h3-27,46H,1-2H3;/q-2;+2.
What are the key properties of 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+)?
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+) has a molecular weight of 892.90 g/mol, XLogP of 11.90, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 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+) is sourced from PubChem (CID 162461441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).