1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)

C41H44GeN2OPt — CID 172528382

IUPAC1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)
SMILESCc1cc(Oc2[c-]c(-c3nccc4c3-c3ccc(CC(C)(C)C)cc3[Ge]4(C)C)cc(C)c2)[c-]c(-c2cc(C(C)(C)C)ccn2)c1.[Pt+2]
InChIInChI=1S/C41H44GeN2O.Pt/c1-26-17-29(37-24-31(13-15-43-37)41(6,7)8)22-32(19-26)45-33-20-27(2)18-30(23-33)39-38-34-12-11-28(25-40(3,4)5)21-36(34)42(9,10)35(38)14-16-44-39;/h11-21,24H,25H2,1-10H3;/q-2;+2
InChIKeyCKAMQYLFDFRPJT-UHFFFAOYSA-N
MW848.50 g/mol
LogP9.51
Rot. Bonds5

About 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)

1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+) (PubChem CID 172528382) has the molecular formula C41H44GeN2OPt and a molecular weight of 848.50 g/mol. Its IUPAC name is 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+).

Molecular Properties

Compound Name1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)
PubChem CID172528382
Molecular FormulaC41H44GeN2OPt
Molecular Weight848.50 g/mol
Exact Mass849.23
IUPAC Name1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)
SMILESCc1cc(Oc2[c-]c(-c3nccc4c3-c3ccc(CC(C)(C)C)cc3[Ge]4(C)C)cc(C)c2)[c-]c(-c2cc(C(C)(C)C)ccn2)c1.[Pt+2]
InChIInChI=1S/C41H44GeN2O.Pt/c1-26-17-29(37-24-31(13-15-43-37)41(6,7)8)22-32(19-26)45-33-20-27(2)18-30(23-33)39-38-34-12-11-28(25-40(3,4)5)21-36(34)42(9,10)35(38)14-16-44-39;/h11-21,24H,25H2,1-10H3;/q-2;+2
InChIKeyCKAMQYLFDFRPJT-UHFFFAOYSA-N
XLogP9.51
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500848.50
LogP ≤ 59.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-tert-butyl-2-[3-tert-butyl-5-[3-tert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]oxybenzene-6-id-1-yl]pyridine;platinum(2+)
CID 153428839
15-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-5-(2,2-dimethylpropyl)-17-oxa-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+)
CID 164939669
15-[4-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxy-5-methyl-3H-thiophen-3-id-2-yl]-5-(2,2-dimethylpropyl)-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,8,11(16),12,14-octaene;platinum(2+)
CID 171724960
2-[4-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-3H-naphthalen-3-id-2-yl]-4-[5-(3,3-difluoro-2,2-dimethylpropyl)-1-benzofuran-2-yl]pyridine;platinum(2+)
CID 176623404
4-[3-[3-(4-tert-butyl-2-pyridinyl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-8-(2,2-dimethylpropyl)-3,7-phenanthroline;platinum(2+)
CID 156667220
4-tert-butyl-2-[3-(3-tert-butyl-5-pyridin-2-ylbenzene-6-id-1-yl)oxybenzene-2-id-1-yl]pyridine;platinum(2+)
CID 153429120
6-[3-methyl-5-(3-methyl-5-pyridin-2-ylbenzene-6-id-1-yl)oxybenzene-6-id-1-yl]-11-(3,3,3-trifluoro-2,2-dimethylpropyl)-8-selena-5-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9(17),10,12,14-octaene;platinum(2+)
CID 169025586
8-(2,2-dimethylpropyl)-3,5,5-trimethylbenzo[b][1]benzogermole
CID 164937401
4-tert-butyl-2-[3-[5-(4-tert-butyl-2-pyridinyl)-2-phenylbenzene-6-id-1-yl]oxy-4-phenylbenzene-2-id-1-yl]pyridine;platinum(2+)
CID 153428858
4-tert-butyl-2-[3-[3-(9-pyridin-2-ylthioxanthen-9-yl)benzene-2-id-1-yl]oxy-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]pyridine;platinum(2+)
CID 162461884
4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;carbanide;platinum(2+)
CID 10962043
4-[3-tert-butyl-5-[3-tert-butyl-5-[2-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]-[1,3]thiazolo[5,4-c]pyridin-4-yl]benzene-6-id-1-yl]oxybenzene-6-id-1-yl]-2-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]-[1,3]thiazolo[5,4-c]pyridine;platinum(2+)
CID 169277740

Frequently Asked Questions

What is the IUPAC name of 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)?
The IUPAC name of 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+) (CID 172528382) is 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+).
What is the SMILES notation for 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)?
The canonical SMILES for 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+) is Cc1cc(Oc2[c-]c(-c3nccc4c3-c3ccc(CC(C)(C)C)cc3[Ge]4(C)C)cc(C)c2)[c-]c(-c2cc(C(C)(C)C)ccn2)c1.[Pt+2].
What is the InChIKey of 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)?
The InChIKey is CKAMQYLFDFRPJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H44GeN2O.Pt/c1-26-17-29(37-24-31(13-15-43-37)41(6,7)8)22-32(19-26)45-33-20-27(2)18-30(23-33)39-38-34-12-11-28(25-40(3,4)5)21-36(34)42(9,10)35(38)14-16-44-39;/h11-21,24H,25H2,1-10H3;/q-2;+2.
What are the key properties of 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+)?
1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+) has a molecular weight of 848.50 g/mol, XLogP of 9.51, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[3-(4-tert-butyl-2-pyridinyl)-5-methylbenzene-2-id-1-yl]oxy-5-methylbenzene-2-id-1-yl]-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-c]pyridine;platinum(2+) is sourced from PubChem (CID 172528382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).