13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene

C258H164N30OS — CID 161032280

About 13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene

13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene (PubChem CID 161032280) has the molecular formula C258H164N30OS and a molecular weight of 3732.43 g/mol. Its IUPAC name is 13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene.

Molecular Properties

• Compound Name: 13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene
• PubChem CID: 161032280
• Molecular Formula: C258H164N30OS
• Molecular Weight: 3732.43 g/mol
• Exact Mass: 3729.34
• IUPAC Name: 13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene
• SMILES: c1ccc(-c2cc(-c3ccccc3)nc(N3c4ccccc4-n4c5ccccc5c5cccc3c54)n2)cc1.c1ccc(-c2ccc3c(c2)N(c2nc(-c4ccccc4)nc(-c4ccccc4)n2)c2cccc4c5ccccc5n-3c24)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)cc4c2n3-c2ccccc2N4c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)c(N3c4ccccc4-n4c5ccccc5c5cccc3c54)c(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc4c5c(c3)c3ccccc3n5-c3ccccc3O4)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)c3cccc5c3n4-c3ccccc3S5)n2)cc1.c1ccc(-c2ncnc(-c3ccccc3)c2N2c3ccccc3-n3c4ccccc4c4cccc2c43)cc1
• InChI: InChI=1S/C45H29N5.C40H26N4.C39H25N5.2C34H22N4.C33H20N4O.C33H20N4S/c1-5-15-30(16-6-1)34-25-26-38-36(27-34)37-28-35(31-17-7-2-8-18-31)29-41-42(37)49(38)39-23-13-14-24-40(39)50(41)45-47-43(32-19-9-3-10-20-32)46-44(48-45)33-21-11-4-12-22-33;1-4-15-27(16-5-1)36-39(37(28-17-6-2-7-18-28)42-40(41-36)29-19-8-3-9-20-29)44-34-25-13-12-24-33(34)43-32-23-11-10-21-30(32)31-22-14-26-35(44)38(31)43;1-4-13-26(14-5-1)29-23-24-33-35(25-29)44(34-22-12-20-31-30-19-10-11-21-32(30)43(33)36(31)34)39-41-37(27-15-6-2-7-16-27)40-38(42-39)28-17-8-3-9-18-28;1-3-12-23(13-4-1)27-22-28(24-14-5-2-6-15-24)36-34(35-27)38-31-20-10-9-19-30(31)37-29-18-8-7-16-25(29)26-17-11-21-32(38)33(26)37;1-3-12-23(13-4-1)31-34(32(36-22-35-31)24-14-5-2-6-15-24)38-29-20-10-9-19-28(29)37-27-18-8-7-16-25(27)26-17-11-21-30(38)33(26)37;1-3-11-21(12-4-1)31-34-32(22-13-5-2-6-14-22)36-33(35-31)23-19-25-24-15-7-8-16-26(24)37-27-17-9-10-18-28(27)38-29(20-23)30(25)37;1-3-10-21(11-4-1)31-34-32(22-12-5-2-6-13-22)36-33(35-31)23-18-19-26-25(20-23)24-14-9-17-29-30(24)37(26)27-15-7-8-16-28(27)38-29/h1-29H;1-26H;1-25H;2*1-22H;2*1-20H
• InChIKey: TZTWEFMCMSFQKQ-UHFFFAOYSA-N
• XLogP: 65.42
• TPSA: 291.96 Ų
• H-Bond Acceptors: 32
• Rotatable Bonds: 25
• Heavy Atoms: 290
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3732.43
LogP ≤ 5	65.42
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of 13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene?

The IUPAC name of 13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene (CID 161032280) is 13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene.

What is the SMILES notation for 13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene?

The canonical SMILES for 13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene is c1ccc(-c2cc(-c3ccccc3)nc(N3c4ccccc4-n4c5ccccc5c5cccc3c54)n2)cc1.c1ccc(-c2ccc3c(c2)N(c2nc(-c4ccccc4)nc(-c4ccccc4)n2)c2cccc4c5ccccc5n-3c24)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)cc4c2n3-c2ccccc2N4c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)c(N3c4ccccc4-n4c5ccccc5c5cccc3c54)c(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc4c5c(c3)c3ccccc3n5-c3ccccc3O4)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)c3cccc5c3n4-c3ccccc3S5)n2)cc1.c1ccc(-c2ncnc(-c3ccccc3)c2N2c3ccccc3-n3c4ccccc4c4cccc2c43)cc1.

What is the InChIKey of 13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene?

The InChIKey is TZTWEFMCMSFQKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H29N5.C40H26N4.C39H25N5.2C34H22N4.C33H20N4O.C33H20N4S/c1-5-15-30(16-6-1)34-25-26-38-36(27-34)37-28-35(31-17-7-2-8-18-31)29-41-42(37)49(38)39-23-13-14-24-40(39)50(41)45-47-43(32-19-9-3-10-20-32)46-44(48-45)33-21-11-4-12-22-33;1-4-15-27(16-5-1)36-39(37(28-17-6-2-7-18-28)42-40(41-36)29-19-8-3-9-20-29)44-34-25-13-12-24-33(34)43-32-23-11-10-21-30(32)31-22-14-26-35(44)38(31)43;1-4-13-26(14-5-1)29-23-24-33-35(25-29)44(34-22-12-20-31-30-19-10-11-21-32(30)43(33)36(31)34)39-41-37(27-15-6-2-7-16-27)40-38(42-39)28-17-8-3-9-18-28;1-3-12-23(13-4-1)27-22-28(24-14-5-2-6-15-24)36-34(35-27)38-31-20-10-9-19-30(31)37-29-18-8-7-16-25(29)26-17-11-21-32(38)33(26)37;1-3-12-23(13-4-1)31-34(32(36-22-35-31)24-14-5-2-6-15-24)38-29-20-10-9-19-28(29)37-27-18-8-7-16-25(27)26-17-11-21-30(38)33(26)37;1-3-11-21(12-4-1)31-34-32(22-13-5-2-6-14-22)36-33(35-31)23-19-25-24-15-7-8-16-26(24)37-27-17-9-10-18-28(27)38-29(20-23)30(25)37;1-3-10-21(11-4-1)31-34-32(22-12-5-2-6-13-22)36-33(35-31)23-18-19-26-25(20-23)24-14-9-17-29-30(24)37(26)27-15-7-8-16-28(27)38-29/h1-29H;1-26H;1-25H;2*1-22H;2*1-20H.

What are the key properties of 13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene?

13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene has a molecular weight of 3732.43 g/mol, XLogP of 65.42, 25 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 13-(4,6-diphenylpyrimidin-2-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,10-diphenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;13-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene;13-(2,4,6-triphenylpyrimidin-5-yl)-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene is sourced from PubChem (CID 161032280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).