3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+))

C178H190F7N21O2Pt5 — CID 158683185

IUPAC3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+))
SMILESCC(C)(C)Cc1cc(-c2[c-]cc(F)nc2F)nc(C(C)(C)c2cc(CC(C)(C)C)cc(-n3[c-]cc(C(F)(F)F)n3)n2)c1.CC(C)(C)Cc1cc(C(C)(C)c2cc(CC(C)(C)C)n(-c3[c-]cc4oc5ccccc5c4c3)n2)nn1-c1[c-]cc2oc3ccccc3c2c1.CCC(C)c1cc(-c2[c-]cc(F)cc2F)nc(C(C)(C)c2cc(CC(C)(C)C)n(-c3[c-]ccc(C#N)c3)n2)c1.Cn1c(-c2[c-]cccc2)nc(C(C)(C)c2nc(-c3[c-]cccc3)n(C)c2CC(C)(C)C)c1CC(C)(C)C.[C-]#[N+]c1cc[c-]c(-c2cc(CC(C)(C)C)cc(C(C)(C)c3cc(CC(C)(C)C)cc(-c4[c-]ccc(C#N)c4)n3)n2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C43H42N4O2.C37H38N4.C33H34F2N4.C33H42N4.C32H34F5N5.5Pt/c1-41(2,3)25-29-23-39(44-46(29)27-17-19-37-33(21-27)31-13-9-11-15-35(31)48-37)43(7,8)40-24-30(26-42(4,5)6)47(45-40)28-18-20-38-34(22-28)32-14-10-12-16-36(32)49-38;1-35(2,3)22-26-17-31(28-13-10-12-25(16-28)24-38)40-33(19-26)37(7,8)34-20-27(23-36(4,5)6)18-32(41-34)29-14-11-15-30(21-29)39-9;1-8-21(2)23-15-29(27-13-12-24(34)17-28(27)35)37-30(16-23)33(6,7)31-18-26(19-32(3,4)5)39(38-31)25-11-9-10-22(14-25)20-36;1-31(2,3)21-25-27(34-29(36(25)9)23-17-13-11-14-18-23)33(7,8)28-26(22-32(4,5)6)37(10)30(35-28)24-19-15-12-16-20-24;1-29(2,3)17-19-13-22(21-9-10-26(33)40-28(21)34)38-24(14-19)31(7,8)25-15-20(18-30(4,5)6)16-27(39-25)42-12-11-23(41-42)32(35,36)37;;;;;/h9-16,19-24H,25-26H2,1-8H3;10-12,15-21H,22-23H2,1-8H3;9-10,12,14-18,21H,8,19H2,1-7H3;11-17,19H,21-22H2,1-10H3;10-11,13-16H,17-18H2,1-8H3;;;;;/q5*-2;5*+2
InChIKeyFSJCZQXMULJVNQ-UHFFFAOYSA-N
MW3764.00 g/mol
LogP44.11
Rot. Bonds31

About 3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+))

3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+)) (PubChem CID 158683185) has the molecular formula C178H190F7N21O2Pt5 and a molecular weight of 3764.00 g/mol. Its IUPAC name is 3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+)).

Molecular Properties

Compound Name3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+))
PubChem CID158683185
Molecular FormulaC178H190F7N21O2Pt5
Molecular Weight3764.00 g/mol
Exact Mass3761.35
IUPAC Name3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+))
SMILESCC(C)(C)Cc1cc(-c2[c-]cc(F)nc2F)nc(C(C)(C)c2cc(CC(C)(C)C)cc(-n3[c-]cc(C(F)(F)F)n3)n2)c1.CC(C)(C)Cc1cc(C(C)(C)c2cc(CC(C)(C)C)n(-c3[c-]cc4oc5ccccc5c4c3)n2)nn1-c1[c-]cc2oc3ccccc3c2c1.CCC(C)c1cc(-c2[c-]cc(F)cc2F)nc(C(C)(C)c2cc(CC(C)(C)C)n(-c3[c-]ccc(C#N)c3)n2)c1.Cn1c(-c2[c-]cccc2)nc(C(C)(C)c2nc(-c3[c-]cccc3)n(C)c2CC(C)(C)C)c1CC(C)(C)C.[C-]#[N+]c1cc[c-]c(-c2cc(CC(C)(C)C)cc(C(C)(C)c3cc(CC(C)(C)C)cc(-c4[c-]ccc(C#N)c4)n3)n2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2]
InChIInChI=1S/C43H42N4O2.C37H38N4.C33H34F2N4.C33H42N4.C32H34F5N5.5Pt/c1-41(2,3)25-29-23-39(44-46(29)27-17-19-37-33(21-27)31-13-9-11-15-35(31)48-37)43(7,8)40-24-30(26-42(4,5)6)47(45-40)28-18-20-38-34(22-28)32-14-10-12-16-36(32)49-38;1-35(2,3)22-26-17-31(28-13-10-12-25(16-28)24-38)40-33(19-26)37(7,8)34-20-27(23-36(4,5)6)18-32(41-34)29-14-11-15-30(21-29)39-9;1-8-21(2)23-15-29(27-13-12-24(34)17-28(27)35)37-30(16-23)33(6,7)31-18-26(19-32(3,4)5)39(38-31)25-11-9-10-22(14-25)20-36;1-31(2,3)21-25-27(34-29(36(25)9)23-17-13-11-14-18-23)33(7,8)28-26(22-32(4,5)6)37(10)30(35-28)24-19-15-12-16-20-24;1-29(2,3)17-19-13-22(21-9-10-26(33)40-28(21)34)38-24(14-19)31(7,8)25-15-20(18-30(4,5)6)16-27(39-25)42-12-11-23(41-42)32(35,36)37;;;;;/h9-16,19-24H,25-26H2,1-8H3;10-12,15-21H,22-23H2,1-8H3;9-10,12,14-18,21H,8,19H2,1-7H3;11-17,19H,21-22H2,1-10H3;10-11,13-16H,17-18H2,1-8H3;;;;;/q5*-2;5*+2
InChIKeyFSJCZQXMULJVNQ-UHFFFAOYSA-N
XLogP44.11
TPSA262.48 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds31
Heavy Atoms213
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003764.00
LogP ≤ 544.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(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

CID 157063556
CID 157063556
2-(3-tert-butylpyrazol-1-id-5-yl)-1-methylpyridin-1-ium;tetrakis(2-(3H-dibenzofuran-3-id-4-yl)quinoline);tetrakis(iridium);1-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridin-1-ium;1-methyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridin-1-ium;1-methyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-1-ium
CID 157083711
2,6-difluoro-3-[6-[2-(1-phenylpyrazol-3-yl)propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-6-[2-[1-[3-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]propan-2-yl]pyrazine;2,6-difluoro-3-[6-[2-[1-[3-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;2,6-dimethyl-3-[6-[2-(1-phenyl-1,2,4-triazol-3-yl)propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;4-[3-[2-[6-(2,6-dimethyl-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]-4-(trifluoromethyl)pyrazol-1-yl]benzene-5-ide-1-carbonitrile;3-[6-[2-[1-(3-methylbenzene-6-id-1-yl)pyrazol-3-yl]propan-2-yl]-2-pyridinyl]-2,6-diphenoxy-4H-pyridin-4-ide;hexakis(platinum(2+))
CID 157084948
pentakis(2-(3H-dibenzofuran-3-id-4-yl)-4-methylquinoline);2-(3H-dibenzofuran-3-id-4-yl)quinoline;tris(iridium(3+));bis(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 157104085
1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-[(1-ethylcyclohexyl)methyl]pyrazol-3-yl]propan-2-yl]-5-[(1-ethylcyclohexyl)methyl]pyrazole;3-[3-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-4-[1-(1-methylcyclohexyl)ethyl]-2-pyridinyl]propan-2-yl]-5-(1-methylcyclohexyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;2,6-difluoro-3-[4-[(1-methylcyclopentyl)methyl]-6-[2-[4-[(1-methylcyclopentyl)methyl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;3-[6-[2-[6-(3-isocyanobenzene-6-id-1-yl)-4-[(1-methylcyclopentyl)methyl]-2-pyridinyl]propan-2-yl]-4-[(1-methylcyclopentyl)methyl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;tetrakis(platinum(2+))
CID 157106810
2-(4-tert-butyl-2H-pyrrol-2-id-1-yl)-6-[2-[6-(4-tert-butyl-2H-pyrrol-2-id-1-yl)-2-pyridinyl]propan-2-yl]pyridine;1-(3H-dibenzofuran-3-id-4-yl)-3-[2-[1-(3H-dibenzofuran-3-id-4-yl)pyrazol-3-yl]propan-2-yl]pyrazole;1-phenyl-3-[2-(1-phenylpyrazol-3-yl)propan-2-yl]pyrazole;pentakis(platinum(2+));2-[4-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-6-[2-[6-[4-(trifluoromethyl)-2H-imidazol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine;2-[4-(trifluoromethyl)-2H-pyrrol-2-id-1-yl]-6-[2-[6-[4-(trifluoromethyl)-2H-pyrrol-2-id-1-yl]-2-pyridinyl]propan-2-yl]pyridine
CID 157190245
2-(3-tert-butylpyrazol-1-id-5-yl)-1-methylpyridin-1-ium;tris(6-(2H-dibenzofuran-2-id-3-yl)pyrido[2,3-b]pyrazine);tris(iridium);1-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridin-1-ium;1-methyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridin-1-ium
CID 157398628
bis(6-(3H-dibenzofuran-3-id-4-yl)pyrido[2,3-b]pyrazine);2-(3H-dibenzofuran-3-id-4-yl)quinoline;tris(iridium(3+));bis(9-methyl-1-pyrido[2,3-b]pyrazin-6-yl-2H-carbazol-2-ide);9-methyl-1-quinolin-2-yl-2H-carbazol-2-ide;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine)
CID 157802126
tris(3-(2H-dibenzofuran-2-id-3-yl)pyrido[2,3-b]pyrazine);tris(iridium);1-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridin-1-ium;1-methyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridin-1-ium;1-methyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-1-ium
CID 157860594
bis(2-(3H-dibenzofuran-3-id-4-yl)-4-methylquinoline);bis(2-(3H-dibenzofuran-3-id-4-yl)quinoline);tris(iridium(3+));bis(9-methyl-1-quinolin-2-yl-2H-carbazol-2-ide);2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine)
CID 158215701
2-(3-tert-butylpyrazol-1-id-5-yl)-1-methylpyridin-1-ium;tris(2-(3H-dibenzofuran-3-id-2-yl)-4-methylquinoline);tris(iridium);1-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridin-1-ium;1-methyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridin-1-ium
CID 158389295
2-(3H-dibenzofuran-3-id-4-yl)-4-methylquinoline;2-(3H-dibenzofuran-3-id-4-yl)quinoline;tris(iridium(3+));bis(9-methyl-1-(4-methylquinolin-2-yl)-2H-carbazol-2-ide);bis(9-methyl-1-quinolin-2-yl-2H-carbazol-2-ide);bis(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 158438915

Frequently Asked Questions

What is the IUPAC name of 3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+))?
The IUPAC name of 3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+)) (CID 158683185) is 3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+)).
What is the SMILES notation for 3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+))?
The canonical SMILES for 3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+)) is CC(C)(C)Cc1cc(-c2[c-]cc(F)nc2F)nc(C(C)(C)c2cc(CC(C)(C)C)cc(-n3[c-]cc(C(F)(F)F)n3)n2)c1.CC(C)(C)Cc1cc(C(C)(C)c2cc(CC(C)(C)C)n(-c3[c-]cc4oc5ccccc5c4c3)n2)nn1-c1[c-]cc2oc3ccccc3c2c1.CCC(C)c1cc(-c2[c-]cc(F)cc2F)nc(C(C)(C)c2cc(CC(C)(C)C)n(-c3[c-]ccc(C#N)c3)n2)c1.Cn1c(-c2[c-]cccc2)nc(C(C)(C)c2nc(-c3[c-]cccc3)n(C)c2CC(C)(C)C)c1CC(C)(C)C.[C-]#[N+]c1cc[c-]c(-c2cc(CC(C)(C)C)cc(C(C)(C)c3cc(CC(C)(C)C)cc(-c4[c-]ccc(C#N)c4)n3)n2)c1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].
What is the InChIKey of 3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+))?
The InChIKey is FSJCZQXMULJVNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H42N4O2.C37H38N4.C33H34F2N4.C33H42N4.C32H34F5N5.5Pt/c1-41(2,3)25-29-23-39(44-46(29)27-17-19-37-33(21-27)31-13-9-11-15-35(31)48-37)43(7,8)40-24-30(26-42(4,5)6)47(45-40)28-18-20-38-34(22-28)32-14-10-12-16-36(32)49-38;1-35(2,3)22-26-17-31(28-13-10-12-25(16-28)24-38)40-33(19-26)37(7,8)34-20-27(23-36(4,5)6)18-32(41-34)29-14-11-15-30(21-29)39-9;1-8-21(2)23-15-29(27-13-12-24(34)17-28(27)35)37-30(16-23)33(6,7)31-18-26(19-32(3,4)5)39(38-31)25-11-9-10-22(14-25)20-36;1-31(2,3)21-25-27(34-29(36(25)9)23-17-13-11-14-18-23)33(7,8)28-26(22-32(4,5)6)37(10)30(35-28)24-19-15-12-16-20-24;1-29(2,3)17-19-13-22(21-9-10-26(33)40-28(21)34)38-24(14-19)31(7,8)25-15-20(18-30(4,5)6)16-27(39-25)42-12-11-23(41-42)32(35,36)37;;;;;/h9-16,19-24H,25-26H2,1-8H3;10-12,15-21H,22-23H2,1-8H3;9-10,12,14-18,21H,8,19H2,1-7H3;11-17,19H,21-22H2,1-10H3;10-11,13-16H,17-18H2,1-8H3;;;;;/q5*-2;5*+2.
What are the key properties of 3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+))?
3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+)) has a molecular weight of 3764.00 g/mol, XLogP of 44.11, 31 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[2-[4-butan-2-yl-6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazol-1-yl]benzene-4-ide-1-carbonitrile;1-(3H-dibenzofuran-3-id-2-yl)-3-[2-[1-(3H-dibenzofuran-3-id-2-yl)-5-(2,2-dimethylpropyl)pyrazol-3-yl]propan-2-yl]-5-(2,2-dimethylpropyl)pyrazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-(3-isocyanobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]benzene-4-ide-1-carbonitrile;5-(2,2-dimethylpropyl)-4-[2-[5-(2,2-dimethylpropyl)-1-methyl-2-phenylimidazol-4-yl]propan-2-yl]-1-methyl-2-phenylimidazole;3-[4-(2,2-dimethylpropyl)-6-[2-[4-(2,2-dimethylpropyl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;pentakis(platinum(2+)) is sourced from PubChem (CID 158683185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).