tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole

C192H104N32Pt3S4 — CID 157396893

IUPACtris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole
SMILES[Pt+2].[Pt+2].[Pt+2].c1ccc2cc3c(cc2c1)-c1nc-3c(-c2cscn2)c2[n-]c(c(-c3cscn3)c3nc(c(-c4cscn4)c4[n-]c(c1-c1cscn1)c1cc5ccccc5cc41)-c1cc4ccccc4cc1-3)c1cc3ccccc3cc21.c1ccc2cc3c(cc2c1)-c1nc-3c(-n2cccn2)c2[n-]c(c(-n3cccn3)c3nc(c(-n4cccn4)c4[n-]c(c1-n1cccn1)c1cc5ccccc5cc41)-c1cc4ccccc4cc1-3)c1cc3ccccc3cc21.c1ccc2cc3c(cc2c1)-c1nc-3c(-n2ccnc2)c2[n-]c(c(-n3ccnc3)c3nc(c(-n4ccnc4)c4[n-]c(c1-n1ccnc1)c1cc5ccccc5cc41)-c1cc4ccccc4cc1-3)c1cc3ccccc3cc21
InChIInChI=1S/2C64H36N12.C64H32N8S4.3Pt/c1-2-14-38-30-46-45(29-37(38)13-1)53-61(73-25-9-21-65-73)55-47-31-39-15-3-4-16-40(39)32-48(47)57(70-55)63(75-27-11-23-67-75)59-51-35-43-19-7-8-20-44(43)36-52(51)60(72-59)64(76-28-12-24-68-76)58-50-34-42-18-6-5-17-41(42)33-49(50)56(71-58)62(54(46)69-53)74-26-10-22-66-74;1-2-10-38-26-46-45(25-37(38)9-1)53-61(73-21-17-65-33-73)55-47-27-39-11-3-4-12-40(39)28-48(47)57(70-55)63(75-23-19-67-35-75)59-51-31-43-15-7-8-16-44(43)32-52(51)60(72-59)64(76-24-20-68-36-76)58-50-30-42-14-6-5-13-41(42)29-49(50)56(71-58)62(54(46)69-53)74-22-18-66-34-74;1-2-10-34-18-42-41(17-33(34)9-1)57-53(49-25-73-29-65-49)59-43-19-35-11-3-4-12-36(35)20-44(43)61(70-59)55(51-27-75-31-67-51)63-47-23-39-15-7-8-16-40(39)24-48(47)64(72-63)56(52-28-76-32-68-52)62-46-22-38-14-6-5-13-37(38)21-45(46)60(71-62)54(58(42)69-57)50-26-74-30-66-50;;;/h2*1-36H;1-32H;;;/q3*-2;3*+2/b2*61-53-,61-55+,62-54+,62-56+,63-57+,63-59+,64-58+,64-60+;57-53-,58-54-,59-53-,60-54-,61-55-,62-56-,63-55-,64-56+;;;
InChIKeyBMRGFDZERKIGOK-LZGIDOIXSA-N
MW3572.67 g/mol
LogP45.45
Rot. Bonds12

About tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole

tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole (PubChem CID 157396893) has the molecular formula C192H104N32Pt3S4 and a molecular weight of 3572.67 g/mol. Its IUPAC name is tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole.

Molecular Properties

Compound Nametris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole
PubChem CID157396893
Molecular FormulaC192H104N32Pt3S4
Molecular Weight3572.67 g/mol
Exact Mass3569.69
IUPAC Nametris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole
SMILES[Pt+2].[Pt+2].[Pt+2].c1ccc2cc3c(cc2c1)-c1nc-3c(-c2cscn2)c2[n-]c(c(-c3cscn3)c3nc(c(-c4cscn4)c4[n-]c(c1-c1cscn1)c1cc5ccccc5cc41)-c1cc4ccccc4cc1-3)c1cc3ccccc3cc21.c1ccc2cc3c(cc2c1)-c1nc-3c(-n2cccn2)c2[n-]c(c(-n3cccn3)c3nc(c(-n4cccn4)c4[n-]c(c1-n1cccn1)c1cc5ccccc5cc41)-c1cc4ccccc4cc1-3)c1cc3ccccc3cc21.c1ccc2cc3c(cc2c1)-c1nc-3c(-n2ccnc2)c2[n-]c(c(-n3ccnc3)c3nc(c(-n4ccnc4)c4[n-]c(c1-n1ccnc1)c1cc5ccccc5cc41)-c1cc4ccccc4cc1-3)c1cc3ccccc3cc21
InChIInChI=1S/2C64H36N12.C64H32N8S4.3Pt/c1-2-14-38-30-46-45(29-37(38)13-1)53-61(73-25-9-21-65-73)55-47-31-39-15-3-4-16-40(39)32-48(47)57(70-55)63(75-27-11-23-67-75)59-51-35-43-19-7-8-20-44(43)36-52(51)60(72-59)64(76-28-12-24-68-76)58-50-34-42-18-6-5-17-41(42)33-49(50)56(71-58)62(54(46)69-53)74-26-10-22-66-74;1-2-10-38-26-46-45(25-37(38)9-1)53-61(73-21-17-65-33-73)55-47-27-39-11-3-4-12-40(39)28-48(47)57(70-55)63(75-23-19-67-35-75)59-51-31-43-15-7-8-16-44(43)32-52(51)60(72-59)64(76-24-20-68-36-76)58-50-30-42-14-6-5-13-41(42)29-49(50)56(71-58)62(54(46)69-53)74-22-18-66-34-74;1-2-10-34-18-42-41(17-33(34)9-1)57-53(49-25-73-29-65-49)59-43-19-35-11-3-4-12-36(35)20-44(43)61(70-59)55(51-27-75-31-67-51)63-47-23-39-15-7-8-16-40(39)24-48(47)64(72-63)56(52-28-76-32-68-52)62-46-22-38-14-6-5-13-37(38)21-45(46)60(71-62)54(58(42)69-57)50-26-74-30-66-50;;;/h2*1-36H;1-32H;;;/q3*-2;3*+2/b2*61-53-,61-55+,62-54+,62-56+,63-57+,63-59+,64-58+,64-60+;57-53-,58-54-,59-53-,60-54-,61-55-,62-56-,63-55-,64-56+;;;
InChIKeyBMRGFDZERKIGOK-LZGIDOIXSA-N
XLogP45.45
TPSA356.06 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds12
Heavy Atoms231
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003572.67
LogP ≤ 545.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole with MolForge

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Related Compounds

2,3-Diphenylindazole;1-fluoro-2-phenylimidazo[1,2-a]quinoline;2-[2-fluoro-4-(trifluoromethyl)phenyl]pyridine;2-naphthalen-2-ylimidazo[1,2-a]pyridine;2-phenyl-1,3-benzothiazole;2-phenylimidazo[1,2-a]pyridine;1-phenylindazole;2-phenylindazole;1-phenylisoquinoline;3-phenylisoquinoline;2-phenylpyrazolo[1,5-a]pyridine;2-phenylpyridine;2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyridine;2-thiophen-2-ylpyridine
CID 157653295
6-{3-[5-(1H-Tetrazol-5-yl)-thiophen-2-yl]-1-trityl-1H-pyrazol-4-yl}-3-thiazol-2-yl-imidazo[1,2-a]pyridine
CID 22031727
CID 59358477
CID 59358477
CID 59358983
CID 59358983
5-[4-[4-(6-Naphthalen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)phenyl]phenyl]-6-phenylimidazo[2,1-b][1,3]thiazole
CID 59999908
6-Naphthalen-2-yl-5-[4-(6-naphthalen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)phenyl]imidazo[2,1-b][1,3]thiazole
CID 59999913
6-Naphthalen-2-yl-5-[4-[4-(6-naphthalen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)phenyl]phenyl]imidazo[2,1-b][1,3]thiazole
CID 59999919
2-[4-[5-[10-[2-[4-([1,3]Thiazolo[5,4-b]pyridin-2-yl)phenyl]pyrimidin-5-yl]anthracen-9-yl]pyrimidin-2-yl]-2-pyridinyl]-7-[4-[5-[4-[5-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]pyrimidin-2-yl]phenyl]pyrimidin-2-yl]-6-[7-[6-([1,3]thiazolo[5,4-b]pyridin-2-yl)-4-[5-[4-[2-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]pyrimidin-5-yl]phenyl]pyrimidin-2-yl]-2-pyridinyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]-2-pyridinyl]-[1,3]thiazolo[5,4-b]pyridine
CID 148272986
2-[3-[5-[4-[2-[4-[7-[6-([1,3]Thiazolo[5,4-b]pyridin-2-yl)-4-[5-[10-[5-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]pyrimidin-2-yl]anthracen-9-yl]pyrimidin-2-yl]-2-pyridinyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]-2-pyridinyl]pyrimidin-5-yl]phenyl]pyrimidin-2-yl]phenyl]-7-[3-([1,3]thiazolo[5,4-b]pyridin-2-yl)-5-[2-[4-[2-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)-2-pyridinyl]pyrimidin-5-yl]phenyl]pyrimidin-5-yl]phenyl]-[1,3]thiazolo[5,4-b]pyridine
CID 149230678
2-[6-(3-Thiophen-2-yl-1-tritylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole
CID 151147238
2-[3-[3-[3-[3-[3-[3-[1-(1-Phenylbenzimidazol-2-yl)pyrazol-3-yl]pyrazol-1-yl]phenyl]phenyl]phenyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]-5-pyrazol-1-yl-1,3-thiazole
CID 154469376
3-N,6-N-dinaphthalen-1-yl-3-N,6-N-diphenylpyrrolo[3,4-c]pyrrole-3,6-diamine;4,7-dinaphthalen-2-yl-[1,2,5]thiadiazolo[3,4-d]pyridazine;5-methyl-2-(4-methylphenyl)-7-(pyridin-2-ylmethylsulfanyl)-[1,2,4]triazolo[1,5-a]pyrimidine;1-[(5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]-[1,2,4]triazolo[3,4-b][1,3]benzothiazole;2,5,7-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 157065470

Frequently Asked Questions

What is the IUPAC name of tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole?
The IUPAC name of tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole (CID 157396893) is tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole.
What is the SMILES notation for tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole?
The canonical SMILES for tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole is [Pt+2].[Pt+2].[Pt+2].c1ccc2cc3c(cc2c1)-c1nc-3c(-c2cscn2)c2[n-]c(c(-c3cscn3)c3nc(c(-c4cscn4)c4[n-]c(c1-c1cscn1)c1cc5ccccc5cc41)-c1cc4ccccc4cc1-3)c1cc3ccccc3cc21.c1ccc2cc3c(cc2c1)-c1nc-3c(-n2cccn2)c2[n-]c(c(-n3cccn3)c3nc(c(-n4cccn4)c4[n-]c(c1-n1cccn1)c1cc5ccccc5cc41)-c1cc4ccccc4cc1-3)c1cc3ccccc3cc21.c1ccc2cc3c(cc2c1)-c1nc-3c(-n2ccnc2)c2[n-]c(c(-n3ccnc3)c3nc(c(-n4ccnc4)c4[n-]c(c1-n1ccnc1)c1cc5ccccc5cc41)-c1cc4ccccc4cc1-3)c1cc3ccccc3cc21.
What is the InChIKey of tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole?
The InChIKey is BMRGFDZERKIGOK-LZGIDOIXSA-N. The full InChI is InChI=1S/2C64H36N12.C64H32N8S4.3Pt/c1-2-14-38-30-46-45(29-37(38)13-1)53-61(73-25-9-21-65-73)55-47-31-39-15-3-4-16-40(39)32-48(47)57(70-55)63(75-27-11-23-67-75)59-51-35-43-19-7-8-20-44(43)36-52(51)60(72-59)64(76-28-12-24-68-76)58-50-34-42-18-6-5-17-41(42)33-49(50)56(71-58)62(54(46)69-53)74-26-10-22-66-74;1-2-10-38-26-46-45(25-37(38)9-1)53-61(73-21-17-65-33-73)55-47-27-39-11-3-4-12-40(39)28-48(47)57(70-55)63(75-23-19-67-35-75)59-51-31-43-15-7-8-16-44(43)32-52(51)60(72-59)64(76-24-20-68-36-76)58-50-30-42-14-6-5-13-41(42)29-49(50)56(71-58)62(54(46)69-53)74-22-18-66-34-74;1-2-10-34-18-42-41(17-33(34)9-1)57-53(49-25-73-29-65-49)59-43-19-35-11-3-4-12-36(35)20-44(43)61(70-59)55(51-27-75-31-67-51)63-47-23-39-15-7-8-16-40(39)24-48(47)64(72-63)56(52-28-76-32-68-52)62-46-22-38-14-6-5-13-37(38)21-45(46)60(71-62)54(58(42)69-57)50-26-74-30-66-50;;;/h2*1-36H;1-32H;;;/q3*-2;3*+2/b2*61-53-,61-55+,62-54+,62-56+,63-57+,63-59+,64-58+,64-60+;57-53-,58-54-,59-53-,60-54-,61-55-,62-56-,63-55-,64-56+;;;.
What are the key properties of tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole?
tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole has a molecular weight of 3572.67 g/mol, XLogP of 45.45, 12 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for tris(platinum(2+));2,15,28,41-tetra(imidazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;2,15,28,41-tetra(pyrazol-1-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaene;4-[15,28,41-tris(1,3-thiazol-4-yl)-53,55-diaza-54,56-diazanidatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52.045,50]hexapentaconta-1(53),2,4,6,8,10,12,14,16(55),17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51-heptacosaen-2-yl]-1,3-thiazole is sourced from PubChem (CID 157396893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).