15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+)

C63H33Cl2N5Pt — CID 162462572

About 15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+)

15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+) (PubChem CID 162462572) has the molecular formula C63H33Cl2N5Pt and a molecular weight of 1125.98 g/mol. Its IUPAC name is 15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+).

Molecular Properties

• Compound Name: 15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+)
• PubChem CID: 162462572
• Molecular Formula: C63H33Cl2N5Pt
• Molecular Weight: 1125.98 g/mol
• Exact Mass: 1124.18
• IUPAC Name: 15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+)
• SMILES: Clc1cccc(-c2c3nc(nc4[n-]c(c(-c5cccc(Cl)c5)c5nc(cc6[n-]c2c2cc7ccccc7cc62)-c2cc6ccccc6cc2-5)c2cc5ccccc5cc42)-c2cc4ccccc4cc2-3)c1.[Pt+2]
• InChI: InChI=1S/C63H33Cl2N5.Pt/c64-44-21-9-19-42(23-44)56-58-48-27-36-13-3-1-11-34(36)25-46(48)54(66-58)33-55-47-26-35-12-2-4-14-37(35)28-49(47)59(67-55)57(43-20-10-22-45(65)24-43)61-51-30-39-16-6-8-18-41(39)32-53(51)63(69-61)70-62-52-31-40-17-7-5-15-38(40)29-50(52)60(56)68-62;/h1-33H;/q-2;+2
• InChIKey: QCKPSQRCGLRKGJ-UHFFFAOYSA-N
• XLogP: 17.19
• TPSA: 66.87 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 2
• Heavy Atoms: 71
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1125.98
LogP ≤ 5	17.19
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+)?

The IUPAC name of 15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+) (CID 162462572) is 15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+).

What is the SMILES notation for 15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+)?

The canonical SMILES for 15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+) is Clc1cccc(-c2c3nc(nc4[n-]c(c(-c5cccc(Cl)c5)c5nc(cc6[n-]c2c2cc7ccccc7cc62)-c2cc6ccccc6cc2-5)c2cc5ccccc5cc42)-c2cc4ccccc4cc2-3)c1.[Pt+2].

What is the InChIKey of 15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+)?

The InChIKey is QCKPSQRCGLRKGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H33Cl2N5.Pt/c64-44-21-9-19-42(23-44)56-58-48-27-36-13-3-1-11-34(36)25-46(48)54(66-58)33-55-47-26-35-12-2-4-14-37(35)28-49(47)59(67-55)57(43-20-10-22-45(65)24-43)61-51-30-39-16-6-8-18-41(39)32-53(51)63(69-61)70-62-52-31-40-17-7-5-15-38(40)29-50(52)60(56)68-62;/h1-33H;/q-2;+2.

What are the key properties of 15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+)?

15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+) has a molecular weight of 1125.98 g/mol, XLogP of 17.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 15,41-bis(3-chlorophenyl)-2,53,55-triaza-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-1,3,5,7,9,11,13,15,17,19,21,23,25,27(55),28,30,32,34,36,38,40,42(53),43,45,47,49,51-heptacosaene;platinum(2+) is sourced from PubChem (CID 162462572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).