2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+))

C111H129N17OPt3 — CID 159457464

IUPAC2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+))
SMILESCC(C)(C)c1cc(-c2cc(-c3cc(C(C)(C)C)n[n-]3)nc(-c3cc(C(C)(C)C)n[n-]3)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2cc3ccccc3c(-c3[n-]nc4c3CCCC4(C)C)n2)[n-]n1.CC(C)(C)c1cc(-c2cc3ccccc3c(-c3cc(C(C)(C)C)n[n-]3)n2)[n-]n1.CC(C)(C)c1ccncc1.CC(C)(C)c1ccncc1.[Pt+2].[Pt+2].[Pt+2].c1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C33H43N5.C25H27N5.C23H25N5.C12H8O.2C9H13N.3Pt/c1-30(2,3)22-13-20(14-23(17-22)31(4,5)6)21-15-24(26-18-28(37-35-26)32(7,8)9)34-25(16-21)27-19-29(38-36-27)33(10,11)12;1-24(2,3)20-14-19(27-28-20)18-13-15-9-6-7-10-16(15)21(26-18)22-17-11-8-12-25(4,5)23(17)30-29-22;1-22(2,3)19-12-17(25-27-19)16-11-14-9-7-8-10-15(14)21(24-16)18-13-20(28-26-18)23(4,5)6;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;2*1-9(2,3)8-4-6-10-7-5-8;;;/h13-19H,1-12H3;6-7,9-10,13-14H,8,11-12H2,1-5H3;7-13H,1-6H3;1-8H;2*4-7H,1-3H3;;;/q3*-2;;;;3*+2
InChIKeyLUDXQSINSRLEAU-UHFFFAOYSA-N
MW2302.60 g/mol
LogP26.37
Rot. Bonds7

About 2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+))

2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+)) (PubChem CID 159457464) has the molecular formula C111H129N17OPt3 and a molecular weight of 2302.60 g/mol. Its IUPAC name is 2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+)).

Molecular Properties

Compound Name2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+))
PubChem CID159457464
Molecular FormulaC111H129N17OPt3
Molecular Weight2302.60 g/mol
Exact Mass2300.95
IUPAC Name2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+))
SMILESCC(C)(C)c1cc(-c2cc(-c3cc(C(C)(C)C)n[n-]3)nc(-c3cc(C(C)(C)C)n[n-]3)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2cc3ccccc3c(-c3[n-]nc4c3CCCC4(C)C)n2)[n-]n1.CC(C)(C)c1cc(-c2cc3ccccc3c(-c3cc(C(C)(C)C)n[n-]3)n2)[n-]n1.CC(C)(C)c1ccncc1.CC(C)(C)c1ccncc1.[Pt+2].[Pt+2].[Pt+2].c1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C33H43N5.C25H27N5.C23H25N5.C12H8O.2C9H13N.3Pt/c1-30(2,3)22-13-20(14-23(17-22)31(4,5)6)21-15-24(26-18-28(37-35-26)32(7,8)9)34-25(16-21)27-19-29(38-36-27)33(10,11)12;1-24(2,3)20-14-19(27-28-20)18-13-15-9-6-7-10-16(15)21(26-18)22-17-11-8-12-25(4,5)23(17)30-29-22;1-22(2,3)19-12-17(25-27-19)16-11-14-9-7-8-10-15(14)21(24-16)18-13-20(28-26-18)23(4,5)6;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;2*1-9(2,3)8-4-6-10-7-5-8;;;/h13-19H,1-12H3;6-7,9-10,13-14H,8,11-12H2,1-5H3;7-13H,1-6H3;1-8H;2*4-7H,1-3H3;;;/q3*-2;;;;3*+2
InChIKeyLUDXQSINSRLEAU-UHFFFAOYSA-N
XLogP26.37
TPSA239.53 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds7
Heavy Atoms132
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002302.60
LogP ≤ 526.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+)) with MolForge

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Launch Full Analysis

Related Compounds

4-tert-butylpyridine;7,7-dimethyl-3-[2-(3-phenylpyrazol-1-id-5-yl)pyrimidin-4-yl]-5,6-dihydro-4H-indazol-2-ide;platinum(2+)
CID 156661596
1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;1,3-bis(5-tert-butyl-1H-pyrazol-3-yl)isoquinoline;bis(4-tert-butylpyridine);platinum(2+)
CID 158649748
1-(3-tert-butylpyrazol-1-id-5-yl)-3-(4,5,6,7-tetrahydroindazol-2-id-3-yl)-2,6-naphthyridine;4-tert-butylpyridine;platinum(2+)
CID 156661553
5-[6-(3-tert-butylpyrazol-1-id-5-yl)pyrazin-2-yl]-1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;4-tert-butylpyridine;platinum(2+)
CID 156661526
2-(3-tert-butylpyrazol-1-id-5-yl)-6-(3-phenylpyrazol-1-id-5-yl)pyrazine;4-tert-butylpyridine;platinum(2+)
CID 169026666
4-tert-butylpyridine;3-[6-(3-phenylpyrazol-1-id-5-yl)pyrazin-2-yl]indazol-2-ide;platinum(2+)
CID 156661705
2-(3-tert-butylpyrazol-1-id-5-yl)-6-(5-ethyl-4-methylpyrazol-2-id-3-yl)pyrazine;tetrakis(4-tert-butylpyridine);2-(5-ethyl-4-methylpyrazol-2-id-3-yl)-6-[3-(2-methylpropyl)-4-propan-2-ylpyrazol-1-id-5-yl]pyrazine;3-[6-(5-ethyl-4-methylpyrazol-2-id-3-yl)pyrazin-2-yl]-4,5,6,7-tetrahydroindazol-2-ide;5-[6-(5-ethyl-4-methylpyrazol-2-id-3-yl)pyrazin-2-yl]-1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;tetrakis(platinum(2+))
CID 157395241
bis(5-isoquinolin-1-yl-1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene);5-isoquinolin-3-yl-1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;3-(7-methyl-7-propan-2-yl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;tris(2-(5-methylpyrazol-2-id-3-yl)pyridine);pentakis(platinum(2+));2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(1,10,10-trimethyl-5-pyridin-2-yl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene)
CID 160784544
4-tert-butylpyridine;3-[2-(3-phenylpyrazol-1-id-5-yl)pyrimidin-4-yl]indazol-2-ide;platinum(2+)
CID 156661508
4-(1,3-dimethylnaphthalen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 140780300
4-dibenzofuran-2-yl-6-(3-dibenzofuran-2-yl-5-pyridin-4-ylphenyl)-2-phenylpyrimidine
CID 154949936
1-[1-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]isoquinolin-3-yl]-[1]benzofuro[3,2-c]pyridine
CID 168746067

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+))?
The IUPAC name of 2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+)) (CID 159457464) is 2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+)).
What is the SMILES notation for 2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+))?
The canonical SMILES for 2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+)) is CC(C)(C)c1cc(-c2cc(-c3cc(C(C)(C)C)n[n-]3)nc(-c3cc(C(C)(C)C)n[n-]3)c2)cc(C(C)(C)C)c1.CC(C)(C)c1cc(-c2cc3ccccc3c(-c3[n-]nc4c3CCCC4(C)C)n2)[n-]n1.CC(C)(C)c1cc(-c2cc3ccccc3c(-c3cc(C(C)(C)C)n[n-]3)n2)[n-]n1.CC(C)(C)c1ccncc1.CC(C)(C)c1ccncc1.[Pt+2].[Pt+2].[Pt+2].c1ccc2c(c1)oc1ccccc12.
What is the InChIKey of 2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+))?
The InChIKey is LUDXQSINSRLEAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H43N5.C25H27N5.C23H25N5.C12H8O.2C9H13N.3Pt/c1-30(2,3)22-13-20(14-23(17-22)31(4,5)6)21-15-24(26-18-28(37-35-26)32(7,8)9)34-25(16-21)27-19-29(38-36-27)33(10,11)12;1-24(2,3)20-14-19(27-28-20)18-13-15-9-6-7-10-16(15)21(26-18)22-17-11-8-12-25(4,5)23(17)30-29-22;1-22(2,3)19-12-17(25-27-19)16-11-14-9-7-8-10-15(14)21(24-16)18-13-20(28-26-18)23(4,5)6;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;2*1-9(2,3)8-4-6-10-7-5-8;;;/h13-19H,1-12H3;6-7,9-10,13-14H,8,11-12H2,1-5H3;7-13H,1-6H3;1-8H;2*4-7H,1-3H3;;;/q3*-2;;;;3*+2.
What are the key properties of 2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+))?
2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+)) has a molecular weight of 2302.60 g/mol, XLogP of 26.37, 7 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(3-tert-butylpyrazol-1-id-5-yl)-4-(3,5-ditert-butylphenyl)pyridine;1,3-bis(3-tert-butylpyrazol-1-id-5-yl)isoquinoline;3-(3-tert-butylpyrazol-1-id-5-yl)-1-(7,7-dimethyl-5,6-dihydro-4H-indazol-2-id-3-yl)isoquinoline;bis(4-tert-butylpyridine);dibenzofuran;tris(platinum(2+)) is sourced from PubChem (CID 159457464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).