5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum

C43H40N5OPt-3 — CID 155633461

IUPAC5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum
SMILESCC1=C(C)N(c2[c-]c(C3(c4[c-]c(Oc5cc(C(C)(C)C)ccn5)n5c(C)c(C)nc5c4)c4ccccc4-c4ccccc43)ccc2)[CH-]N1C.[Pt]
InChIInChI=1S/C43H40N5O.Pt/c1-27-28(2)48-39(45-27)23-33(25-41(48)49-40-24-31(20-21-44-40)42(5,6)7)43(37-18-11-9-16-35(37)36-17-10-12-19-38(36)43)32-14-13-15-34(22-32)47-26-46(8)29(3)30(47)4;/h9-21,23-24,26H,1-8H3;/q-3;
InChIKeyBHEAQSMOMHNVKP-UHFFFAOYSA-N
MW837.91 g/mol
LogP9.52
Rot. Bonds5

About 5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum

5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum (PubChem CID 155633461) has the molecular formula C43H40N5OPt-3 and a molecular weight of 837.91 g/mol. Its IUPAC name is 5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum.

Molecular Properties

Compound Name5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum
PubChem CID155633461
Molecular FormulaC43H40N5OPt-3
Molecular Weight837.91 g/mol
Exact Mass837.29
IUPAC Name5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum
SMILESCC1=C(C)N(c2[c-]c(C3(c4[c-]c(Oc5cc(C(C)(C)C)ccn5)n5c(C)c(C)nc5c4)c4ccccc4-c4ccccc43)ccc2)[CH-]N1C.[Pt]
InChIInChI=1S/C43H40N5O.Pt/c1-27-28(2)48-39(45-27)23-33(25-41(48)49-40-24-31(20-21-44-40)42(5,6)7)43(37-18-11-9-16-35(37)36-17-10-12-19-38(36)43)32-14-13-15-34(22-32)47-26-46(8)29(3)30(47)4;/h9-21,23-24,26H,1-8H3;/q-3;
InChIKeyBHEAQSMOMHNVKP-UHFFFAOYSA-N
XLogP9.52
TPSA45.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500837.91
LogP ≤ 59.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum with MolForge

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Launch Full Analysis

Related Compounds

1-Benzyl-4-[5-methoxy-1-[[6-(trifluoromethyl)pyridin-3-yl]methyl]-2,3-dihydroinden-1-yl]imidazol-2-amine
CID 44186788
1-Benzyl-4-[1-[[6-(1,1-difluoroethyl)pyridin-3-yl]methyl]-5-methoxy-2,3-dihydroinden-1-yl]imidazol-2-amine
CID 58138224
3-(2,6-dimethylphenyl)-11-(9,9-dimethyl-3-pyridin-2-yloxy-4H-acridin-4-id-10-yl)-12H-imidazo[1,2-f]phenanthridin-12-ide;platinum(2+)
CID 140709664
[3-[1-[2,6-Di(propan-2-yl)phenyl]imidazol-4-yl]benzene-2-id-1-yl]-diphenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)silane;platinum(2+)
CID 145837152
[3-[1-[2,6-Di(propan-2-yl)phenyl]imidazol-4-yl]benzene-2-id-1-yl]-phenyl-(3-pyridin-2-yloxybenzene-2-id-1-yl)borane;platinum(2+)
CID 145837158
3-[1-(2,6-dimethylphenyl)imidazol-4-yl]-N-phenyl-N-(3-pyridin-2-yloxybenzene-2-id-1-yl)benzene-2-id-1-amine;platinum(2+)
CID 145837186
3-[1-(2,6-dimethylphenyl)-2-pyridin-2-yloxyimidazol-4-yl]-9,9-dimethyl-10-phenyl-4H-acridin-4-ide;platinum(2+)
CID 153423548
2-[3-[[3-(4-tert-butyl-2-pyridinyl)-2H-naphthalen-2-id-1-yl]oxy]benzene-2-id-1-yl]-1-methylbenzimidazole;platinum(2+)
CID 153429106
4-Tert-butyl-2-[9-(3-imidazol-1-ylphenyl)fluoren-9-yl]-6-phenoxypyridine
CID 155113838
4-Tert-butyl-2-[9-[3-(3-methylimidazol-3-ium-1-yl)phenyl]fluoren-9-yl]-6-phenoxypyridine
CID 155113839
4-Tert-butyl-2-[3-(3-methylimidazol-3-ium-1-yl)phenoxy]-6-(9-phenylfluoren-9-yl)pyridine
CID 155614496
4-tert-butyl-2-[9-[3-(1H-imidazol-3-ium-3-yl)phenyl]fluoren-9-yl]-6-phenoxypyridine
CID 155614502

Frequently Asked Questions

What is the IUPAC name of 5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum?
The IUPAC name of 5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum (CID 155633461) is 5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum.
What is the SMILES notation for 5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum?
The canonical SMILES for 5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum is CC1=C(C)N(c2[c-]c(C3(c4[c-]c(Oc5cc(C(C)(C)C)ccn5)n5c(C)c(C)nc5c4)c4ccccc4-c4ccccc43)ccc2)[CH-]N1C.[Pt].
What is the InChIKey of 5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum?
The InChIKey is BHEAQSMOMHNVKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H40N5O.Pt/c1-27-28(2)48-39(45-27)23-33(25-41(48)49-40-24-31(20-21-44-40)42(5,6)7)43(37-18-11-9-16-35(37)36-17-10-12-19-38(36)43)32-14-13-15-34(22-32)47-26-46(8)29(3)30(47)4;/h9-21,23-24,26H,1-8H3;/q-3;.
What are the key properties of 5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum?
5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum has a molecular weight of 837.91 g/mol, XLogP of 9.52, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-7-[9-[3-(3,4,5-trimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-6H-imidazo[1,2-a]pyridin-6-ide;platinum is sourced from PubChem (CID 155633461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).