15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum

C46H39F2GeN2OPt- — CID 176607088

IUPAC15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum
SMILESCC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cc3ccc(-c4ccc([Ge](C)(C)C)cc4)c4c3c(n2)-c2c(O)cccc2C4(F)F)c1.[Pt]
InChIInChI=1S/C46H39F2GeN2O.Pt/c1-45(2,3)34-24-32(38-26-30(21-22-50-38)28-11-8-7-9-12-28)23-33(25-34)39-27-31-17-20-36(29-15-18-35(19-16-29)49(4,5)6)43-41(31)44(51-39)42-37(46(43,47)48)13-10-14-40(42)52;/h7-22,24-27,52H,1-6H3;/q-1;
InChIKeyQIJHZWQZTNLMKS-UHFFFAOYSA-N
MW941.51 g/mol
LogP11.76
Rot. Bonds5

About 15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum

15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum (PubChem CID 176607088) has the molecular formula C46H39F2GeN2OPt- and a molecular weight of 941.51 g/mol. Its IUPAC name is 15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum.

Molecular Properties

Compound Name15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum
PubChem CID176607088
Molecular FormulaC46H39F2GeN2OPt-
Molecular Weight941.51 g/mol
Exact Mass942.19
IUPAC Name15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum
SMILESCC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cc3ccc(-c4ccc([Ge](C)(C)C)cc4)c4c3c(n2)-c2c(O)cccc2C4(F)F)c1.[Pt]
InChIInChI=1S/C46H39F2GeN2O.Pt/c1-45(2,3)34-24-32(38-26-30(21-22-50-38)28-11-8-7-9-12-28)23-33(25-34)39-27-31-17-20-36(29-15-18-35(19-16-29)49(4,5)6)43-41(31)44(51-39)42-37(46(43,47)48)13-10-14-40(42)52;/h7-22,24-27,52H,1-6H3;/q-1;
InChIKeyQIJHZWQZTNLMKS-UHFFFAOYSA-N
XLogP11.76
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500941.51
LogP ≤ 511.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum with MolForge

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Related Compounds

Platinum;2-[[3-(6-pyridin-2-yl-2-pyridinyl)-5-[2,4,6-tris(trifluoromethyl)phenyl]benzene-2-id-1-yl]methyl]phenol
CID 58004339
2-[[3-[4-Methyl-2,6-bis(trifluoromethyl)phenyl]-5-(6-pyridin-2-yl-2-pyridinyl)benzene-6-id-1-yl]methyl]phenol;platinum
CID 58620926
2-[4-(3,5-Ditert-butylphenyl)-6-(4-fluoro-3-isoquinolin-3-ylphenyl)-2-pyridinyl]-3,6-difluorophenol
CID 136012898
2-(4-Fluoro-3-isoquinolin-3-ylphenyl)-5,5-dihexylindeno[1,2-b]pyridin-9-ol
CID 136012940
5,5-Dibutyl-2-(4-fluoro-3-isoquinolin-3-ylphenyl)indeno[1,2-b]pyridin-9-ol
CID 136012952
2-[4-(3,5-Ditert-butylphenyl)-6-(4-fluoro-3-isoquinolin-3-ylphenyl)-2-pyridinyl]phenol
CID 136635372
2-[7-(4-Fluorophenyl)-9-pyridin-2-yl-5,6-dihydrobenzo[h]quinolin-2-yl]phenol
CID 146591687
2-[7-(2,3,4,5,6-Pentafluorophenyl)-9-pyridin-2-yl-5,6-dihydrobenzo[h]quinolin-2-yl]phenol
CID 146591716
3-(2,2-Dimethylpropyl)-6-[3-[3-[5-(2,2-dimethylpropyl)-6-fluoro-2-pyridinyl]phenyl]phenyl]-2-[2-(2,2-dimethylpropyl)-5-pyridin-2-ylphenyl]phenol
CID 156487298
CID 158348147
CID 158348147
5,7-Bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;dioxotungsten;7-(4-methylphenyl)-5-[4-(trifluoromethyl)phenyl]quinolin-8-ol
CID 160581931
CID 161560024
CID 161560024

Frequently Asked Questions

What is the IUPAC name of 15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum?
The IUPAC name of 15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum (CID 176607088) is 15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum.
What is the SMILES notation for 15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum?
The canonical SMILES for 15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum is CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cc3ccc(-c4ccc([Ge](C)(C)C)cc4)c4c3c(n2)-c2c(O)cccc2C4(F)F)c1.[Pt].
What is the InChIKey of 15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum?
The InChIKey is QIJHZWQZTNLMKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H39F2GeN2O.Pt/c1-45(2,3)34-24-32(38-26-30(21-22-50-38)28-11-8-7-9-12-28)23-33(25-34)39-27-31-17-20-36(29-15-18-35(19-16-29)49(4,5)6)43-41(31)44(51-39)42-37(46(43,47)48)13-10-14-40(42)52;/h7-22,24-27,52H,1-6H3;/q-1;.
What are the key properties of 15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum?
15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum has a molecular weight of 941.51 g/mol, XLogP of 11.76, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 15-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-8,8-difluoro-10-(4-trimethylgermylphenyl)-16-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-3-ol;platinum is sourced from PubChem (CID 176607088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).