21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene

C248H144N32 — CID 158393653

About 21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene

21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene (PubChem CID 158393653) has the molecular formula C248H144N32 and a molecular weight of 3572.10 g/mol. Its IUPAC name is 21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene.

Molecular Properties

• Compound Name: 21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene
• PubChem CID: 158393653
• Molecular Formula: C248H144N32
• Molecular Weight: 3572.10 g/mol
• Exact Mass: 3569.23
• IUPAC Name: 21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene
• SMILES: c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3cccnc3c3ccncc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3cccnc3c3cnccc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3ccncc3c3ccncc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3ccncc3c3cnccc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3cnccc3c3ccncc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3cnccc3c3cnccc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3ncccc3c3ccncc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3ncccc3c3cnccc3n21
• InChI: InChI=1S/8C31H18N4/c1-2-5-20-17(4-1)12-18-13-25-19(14-24(18)20)15-26-21(25)7-8-27-30(26)34-31-23-6-3-10-33-29(23)22-9-11-32-16-28(22)35(27)31;1-2-5-20-17(4-1)12-18-13-25-19(14-24(18)20)15-26-21(25)7-8-27-29(26)34-31-30-23(6-3-10-33-30)22-9-11-32-16-28(22)35(27)31;1-2-5-20-17(4-1)12-18-13-24-19(14-23(18)20)15-25-21(24)7-8-28-30(25)34-31-22-6-3-10-33-29(22)26-16-32-11-9-27(26)35(28)31;1-2-5-20-17(4-1)12-18-13-24-19(14-23(18)20)15-25-21(24)7-8-28-29(25)34-31-30-22(6-3-10-33-30)26-16-32-11-9-27(26)35(28)31;1-2-4-20-17(3-1)11-18-12-24-19(13-23(18)20)14-25-21(24)5-6-29-30(25)34-31-22-7-9-32-15-26(22)27-16-33-10-8-28(27)35(29)31;1-2-4-20-17(3-1)11-18-12-24-19(13-23(18)20)14-25-21(24)5-6-29-30(25)34-31-27-16-32-9-7-22(27)26-15-33-10-8-28(26)35(29)31;1-2-4-20-17(3-1)11-18-12-25-19(13-24(18)20)14-26-21(25)5-6-28-30(26)34-31-23-8-10-32-15-27(23)22-7-9-33-16-29(22)35(28)31;1-2-4-20-17(3-1)11-18-12-25-19(13-24(18)20)14-26-21(25)5-6-28-30(26)34-31-27-15-32-9-7-22(27)23-8-10-33-16-29(23)35(28)31/h4*1-11,13-14,16H,12,15H2;4*1-10,12-13,15-16H,11,14H2
• InChIKey: GXGXGGFQCQAGTM-UHFFFAOYSA-N
• XLogP: 53.81
• TPSA: 344.64 Ų
• H-Bond Acceptors: 32
• Heavy Atoms: 280
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3572.10
LogP ≤ 5	53.81
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene?

The IUPAC name of 21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene (CID 158393653) is 21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene.

What is the SMILES notation for 21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene?

The canonical SMILES for 21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene is c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3cccnc3c3ccncc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3cccnc3c3cnccc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3ccncc3c3ccncc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3ccncc3c3cnccc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3cnccc3c3ccncc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3cnccc3c3cnccc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3ncccc3c3ccncc3n21.c1ccc2c(c1)Cc1cc3c(cc1-2)Cc1c-3ccc2c1nc1c3ncccc3c3cnccc3n21.

What is the InChIKey of 21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene?

The InChIKey is GXGXGGFQCQAGTM-UHFFFAOYSA-N. The full InChI is InChI=1S/8C31H18N4/c1-2-5-20-17(4-1)12-18-13-25-19(14-24(18)20)15-26-21(25)7-8-27-30(26)34-31-23-6-3-10-33-29(23)22-9-11-32-16-28(22)35(27)31;1-2-5-20-17(4-1)12-18-13-25-19(14-24(18)20)15-26-21(25)7-8-27-29(26)34-31-30-23(6-3-10-33-30)22-9-11-32-16-28(22)35(27)31;1-2-5-20-17(4-1)12-18-13-24-19(14-23(18)20)15-25-21(24)7-8-28-30(25)34-31-22-6-3-10-33-29(22)26-16-32-11-9-27(26)35(28)31;1-2-5-20-17(4-1)12-18-13-24-19(14-23(18)20)15-25-21(24)7-8-28-29(25)34-31-30-22(6-3-10-33-30)26-16-32-11-9-27(26)35(28)31;1-2-4-20-17(3-1)11-18-12-24-19(13-23(18)20)14-25-21(24)5-6-29-30(25)34-31-22-7-9-32-15-26(22)27-16-33-10-8-28(27)35(29)31;1-2-4-20-17(3-1)11-18-12-24-19(13-23(18)20)14-25-21(24)5-6-29-30(25)34-31-27-16-32-9-7-22(27)26-15-33-10-8-28(26)35(29)31;1-2-4-20-17(3-1)11-18-12-25-19(13-24(18)20)14-26-21(25)5-6-28-30(26)34-31-23-8-10-32-15-27(23)22-7-9-33-16-29(22)35(28)31;1-2-4-20-17(3-1)11-18-12-25-19(13-24(18)20)14-26-21(25)5-6-28-30(26)34-31-27-15-32-9-7-22(27)23-8-10-33-16-29(23)35(28)31/h4*1-11,13-14,16H,12,15H2;4*1-10,12-13,15-16H,11,14H2.

What are the key properties of 21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene?

21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene has a molecular weight of 3572.10 g/mol, XLogP of 53.81, 0 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 21,24,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,24,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,29,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,30,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,31,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene;21,25,32,35-tetrazanonacyclo[18.15.0.02,17.04,16.06,14.07,12.021,34.022,27.028,33]pentatriaconta-1(20),2(17),4(16),5,7,9,11,14,18,22(27),23,25,28(33),29,31,34-hexadecaene is sourced from PubChem (CID 158393653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).