22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene

C269H179N29O2 — CID 159976100

About 22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene

22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene (PubChem CID 159976100) has the molecular formula C269H179N29O2 and a molecular weight of 3849.59 g/mol. Its IUPAC name is 22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene.

Molecular Properties

• Compound Name: 22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene
• PubChem CID: 159976100
• Molecular Formula: C269H179N29O2
• Molecular Weight: 3849.59 g/mol
• Exact Mass: 3846.48
• IUPAC Name: 22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene
• SMILES: c1ccc(-c2cc(-c3ccc(-n4c5c(c6ccccc64)-c4cnccc4Oc4ccccc4-5)cc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccc(-n4c5c(c6ccccc64)-c4cnccc4Oc4ccccc4-5)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccc(-n4c5c(c6ncccc64)-c4ccccc4N(c4ccccc4)c4ccccc4-5)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc(N4c5cnccc5C5c6ccccc6N(c6ccccc6)c6ccccc6C54)c3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5c(c6ccccc64)-c4cnccc4N(c4ccccc4)c4ccccc4-5)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(N4c5ncccc5C5c6ccccc6N(c6ccccc6)c6ccccc6C54)c3)n2)cc1
• InChI: InChI=1S/C47H33N5.C47H31N5.C46H32N6.C46H30N6.C42H27N3O.C41H26N4O/c1-4-15-32(16-5-1)40-30-41(50-47(49-40)33-17-6-2-7-18-33)34-19-14-22-36(29-34)52-44-31-48-28-27-38(44)45-37-23-10-12-25-42(37)51(35-20-8-3-9-21-35)43-26-13-11-24-39(43)46(45)52;1-4-15-32(16-5-1)39-31-40(50-47(49-39)34-17-6-2-7-18-34)33-26-28-36(29-27-33)52-43-25-14-30-48-45(43)44-37-21-10-12-23-41(37)51(35-19-8-3-9-20-35)42-24-13-11-22-38(42)46(44)52;1-4-16-31(17-5-1)43-48-44(32-18-6-2-7-19-32)50-45(49-43)33-20-14-23-35(30-33)52-42-37-25-11-13-28-40(37)51(34-21-8-3-9-22-34)39-27-12-10-24-36(39)41(42)38-26-15-29-47-46(38)52;1-4-14-31(15-5-1)44-48-45(32-16-6-2-7-17-32)50-46(49-44)33-24-26-35(27-25-33)52-39-22-12-10-20-36(39)42-38-30-47-29-28-41(38)51(34-18-8-3-9-19-34)40-23-13-11-21-37(40)43(42)52;1-3-11-29(12-4-1)36-25-31(26-37(44-36)30-13-5-2-6-14-30)28-19-21-32(22-20-28)45-38-17-9-7-15-33(38)41-35-27-43-24-23-40(35)46-39-18-10-8-16-34(39)42(41)45;1-3-11-27(12-4-1)34-25-35(44-41(43-34)29-13-5-2-6-14-29)28-19-21-30(22-20-28)45-36-17-9-7-15-31(36)39-33-26-42-24-23-38(33)46-37-18-10-8-16-32(37)40(39)45/h1-31,45-46H;1-31H;1-30,41-42H;1-30H;1-27H;1-26H
• InChIKey: OFEGEWXWKDWUSK-UHFFFAOYSA-N
• XLogP: 67.14
• TPSA: 302.53 Ų
• H-Bond Acceptors: 31
• Rotatable Bonds: 28
• Heavy Atoms: 300
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3849.59
LogP ≤ 5	67.14
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene?

The IUPAC name of 22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene (CID 159976100) is 22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene.

What is the SMILES notation for 22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene?

The canonical SMILES for 22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene is c1ccc(-c2cc(-c3ccc(-n4c5c(c6ccccc64)-c4cnccc4Oc4ccccc4-5)cc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccc(-n4c5c(c6ccccc64)-c4cnccc4Oc4ccccc4-5)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccc(-n4c5c(c6ncccc64)-c4ccccc4N(c4ccccc4)c4ccccc4-5)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3cccc(N4c5cnccc5C5c6ccccc6N(c6ccccc6)c6ccccc6C54)c3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5c(c6ccccc64)-c4cnccc4N(c4ccccc4)c4ccccc4-5)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(N4c5ncccc5C5c6ccccc6N(c6ccccc6)c6ccccc6C54)c3)n2)cc1.

What is the InChIKey of 22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene?

The InChIKey is OFEGEWXWKDWUSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H33N5.C47H31N5.C46H32N6.C46H30N6.C42H27N3O.C41H26N4O/c1-4-15-32(16-5-1)40-30-41(50-47(49-40)33-17-6-2-7-18-33)34-19-14-22-36(29-34)52-44-31-48-28-27-38(44)45-37-23-10-12-25-42(37)51(35-20-8-3-9-21-35)43-26-13-11-24-39(43)46(45)52;1-4-15-32(16-5-1)39-31-40(50-47(49-39)34-17-6-2-7-18-34)33-26-28-36(29-27-33)52-43-25-14-30-48-45(43)44-37-21-10-12-23-41(37)51(35-19-8-3-9-20-35)42-24-13-11-22-38(42)46(44)52;1-4-16-31(17-5-1)43-48-44(32-18-6-2-7-19-32)50-45(49-43)33-20-14-23-35(30-33)52-42-37-25-11-13-28-40(37)51(34-21-8-3-9-22-34)39-27-12-10-24-36(39)41(42)38-26-15-29-47-46(38)52;1-4-14-31(15-5-1)44-48-45(32-16-6-2-7-17-32)50-46(49-44)33-24-26-35(27-25-33)52-39-22-12-10-20-36(39)42-38-30-47-29-28-41(38)51(34-18-8-3-9-19-34)40-23-13-11-21-37(40)43(42)52;1-3-11-29(12-4-1)36-25-31(26-37(44-36)30-13-5-2-6-14-30)28-19-21-32(22-20-28)45-38-17-9-7-15-33(38)41-35-27-43-24-23-40(35)46-39-18-10-8-16-34(39)42(41)45;1-3-11-27(12-4-1)34-25-35(44-41(43-34)29-13-5-2-6-14-29)28-19-21-30(22-20-28)45-36-17-9-7-15-31(36)39-33-26-42-24-23-38(33)46-37-18-10-8-16-32(37)40(39)45/h1-31,45-46H;1-31H;1-30,41-42H;1-30H;1-27H;1-26H.

What are the key properties of 22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene?

22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene has a molecular weight of 3849.59 g/mol, XLogP of 67.14, 28 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 22-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-oxa-12,22-diazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,17,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16(21),17,19-decaene;22-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-8-phenyl-8,19,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene;22-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,12,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9(14),10,12,16,18,20-decaene;22-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-8,20,22-triazapentacyclo[13.7.0.02,7.09,14.016,21]docosa-2,4,6,9,11,13,16(21),17,19-nonaene is sourced from PubChem (CID 159976100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).