4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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

C240H144N16O4Pt3S4 — CID 158953681

About 4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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 (PubChem CID 158953681) has the molecular formula C240H144N16O4Pt3S4 and a molecular weight of 4029.40 g/mol. Its IUPAC name is 4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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.

Molecular Properties

• Compound Name: 4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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
• PubChem CID: 158953681
• Molecular Formula: C240H144N16O4Pt3S4
• Molecular Weight: 4029.40 g/mol
• Exact Mass: 4025.94
• IUPAC Name: 4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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
• SMILES: COc1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4[n-]c(c(-c5ccc(OC)cc5)c5nc(c(-c6ccc(OC)cc6)c6[n-]c2c2cc7ccccc7cc62)-c2cc6ccccc6cc2-5)c2cc5ccccc5cc42)-c2cc4ccccc4cc2-3)cc1.CSc1ccc(-c2c3nc(c(-c4ccc(SC)cc4)c4[n-]c(c(-c5ccc(SC)cc5)c5nc(c(-c6ccc(SC)cc6)c6[n-]c2c2cc7ccccc7cc62)-c2cc6ccccc6cc2-5)c2cc5ccccc5cc42)-c2cc4ccccc4cc2-3)cc1.[C-]#[N+]c1ccc(-c2c3nc(c(-c4ccc(C#N)cc4)c4[n-]c(c(-c5ccc(C#N)cc5)c5nc(c(-c6ccc([N+]#[C-])cc6)c6[n-]c2c2cc7ccccc7cc62)-c2cc6ccccc6cc2-5)c2cc5ccccc5cc42)-c2cc4ccccc4cc2-3)cc1.[Pt+2].[Pt+2].[Pt+2]
• InChI: InChI=1S/C80H40N8.C80H52N4O4.C80H52N4S4.3Pt/c1-83-59-31-27-49(28-32-59)71-77-65-39-55-15-7-5-13-53(55)37-63(65)75(86-77)69(47-23-19-45(43-81)20-24-47)73-61-35-51-11-3-4-12-52(51)36-62(61)74(85-73)70(48-25-21-46(44-82)22-26-48)76-64-38-54-14-6-8-16-56(54)40-66(64)78(87-76)72(50-29-33-60(84-2)34-30-50)80-68-42-58-18-10-9-17-57(58)41-67(68)79(71)88-80;2*1-85-57-29-21-45(22-30-57)69-73-61-37-49-13-5-7-15-51(49)39-63(61)75(81-73)70(46-23-31-58(86-2)32-24-46)77-65-41-53-17-9-11-19-55(53)43-67(65)79(83-77)72(48-27-35-60(88-4)36-28-48)80-68-44-56-20-12-10-18-54(56)42-66(68)78(84-80)71(47-25-33-59(87-3)34-26-47)76-64-40-52-16-8-6-14-50(52)38-62(64)74(69)82-76;;;/h3-42H;2*5-44H,1-4H3;;;/q3*-2;3*+2/b73-69-,74-70-,75-69-,76-70-,77-71-,78-72+,79-71-,80-72-;2*73-69-,74-69-,75-70-,76-71-,77-70-,78-71-,79-72-,80-72+
• InChIKey: JLSXQDKGSFPCAB-JHDYJEOWSA-N
• XLogP: 63.24
• TPSA: 255.16 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 20
• Heavy Atoms: 267
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4029.40
LogP ≤ 5	63.24
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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?

The IUPAC name of 4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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 (CID 158953681) is 4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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.

What is the SMILES notation for 4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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?

The canonical SMILES for 4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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 is COc1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4[n-]c(c(-c5ccc(OC)cc5)c5nc(c(-c6ccc(OC)cc6)c6[n-]c2c2cc7ccccc7cc62)-c2cc6ccccc6cc2-5)c2cc5ccccc5cc42)-c2cc4ccccc4cc2-3)cc1.CSc1ccc(-c2c3nc(c(-c4ccc(SC)cc4)c4[n-]c(c(-c5ccc(SC)cc5)c5nc(c(-c6ccc(SC)cc6)c6[n-]c2c2cc7ccccc7cc62)-c2cc6ccccc6cc2-5)c2cc5ccccc5cc42)-c2cc4ccccc4cc2-3)cc1.[C-]#[N+]c1ccc(-c2c3nc(c(-c4ccc(C#N)cc4)c4[n-]c(c(-c5ccc(C#N)cc5)c5nc(c(-c6ccc([N+]#[C-])cc6)c6[n-]c2c2cc7ccccc7cc62)-c2cc6ccccc6cc2-5)c2cc5ccccc5cc42)-c2cc4ccccc4cc2-3)cc1.[Pt+2].[Pt+2].[Pt+2].

What is the InChIKey of 4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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?

The InChIKey is JLSXQDKGSFPCAB-JHDYJEOWSA-N. The full InChI is InChI=1S/C80H40N8.C80H52N4O4.C80H52N4S4.3Pt/c1-83-59-31-27-49(28-32-59)71-77-65-39-55-15-7-5-13-53(55)37-63(65)75(86-77)69(47-23-19-45(43-81)20-24-47)73-61-35-51-11-3-4-12-52(51)36-62(61)74(85-73)70(48-25-21-46(44-82)22-26-48)76-64-38-54-14-6-8-16-56(54)40-66(64)78(87-76)72(50-29-33-60(84-2)34-30-50)80-68-42-58-18-10-9-17-57(58)41-67(68)79(71)88-80;2*1-85-57-29-21-45(22-30-57)69-73-61-37-49-13-5-7-15-51(49)39-63(61)75(81-73)70(46-23-31-58(86-2)32-24-46)77-65-41-53-17-9-11-19-55(53)43-67(65)79(83-77)72(48-27-35-60(88-4)36-28-48)80-68-44-56-20-12-10-18-54(56)42-66(68)78(84-80)71(47-25-33-59(87-3)34-26-47)76-64-40-52-16-8-6-14-50(52)38-62(64)74(69)82-76;;;/h3-42H;2*5-44H,1-4H3;;;/q3*-2;3*+2/b73-69-,74-70-,75-69-,76-70-,77-71-,78-72+,79-71-,80-72-;2*73-69-,74-69-,75-70-,76-71-,77-70-,78-71-,79-72-,80-72+;;;.

What are the key properties of 4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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 has a molecular weight of 4029.40 g/mol, XLogP of 63.24, 20 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[15-(4-cyanophenyl)-28,41-bis(4-isocyanophenyl)-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]benzonitrile;tris(platinum(2+));2,15,28,41-tetrakis(4-methoxyphenyl)-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-tetrakis(4-methylsulfanylphenyl)-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 is sourced from PubChem (CID 158953681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).