2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine

C316H188F4N32O8 — CID 158446960

About 2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine

2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine (PubChem CID 158446960) has the molecular formula C316H188F4N32O8 and a molecular weight of 4637.19 g/mol. Its IUPAC name is 2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine.

Molecular Properties

• Compound Name: 2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine
• PubChem CID: 158446960
• Molecular Formula: C316H188F4N32O8
• Molecular Weight: 4637.19 g/mol
• Exact Mass: 4633.52
• IUPAC Name: 2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine
• SMILES: Fc1c(F)c(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(F)c(F)c1-c1ccc(N2c3ccccc3-n3c4ccccc4c4cccc2c43)cc1.N#Cc1cc(-c2cc(C#N)cc(-n3c4ccccc4c4cc(N(c5ccccc5)c5ccccc5)ccc43)c2)cc(N2c3ccccc3-n3c4ccccc4c4cccc2c43)c1.c1ccc2c(c1)N(c1ccc3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)oc3c1)c1cccc3c4ccccc4n-2c13.c1ccc2c(c1)N(c1cnc3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)oc3c1)c1cccc3c4ccccc4n-2c13.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2nc3ccc(N4c5ccccc5-n5c6ccccc6c6cccc4c65)cc3o2)cc1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2nc3ccc(N4c5ccccc5-n5c6ccccc6c6cccc4c65)cc3o2)nc1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2nc3ncc(N4c5ccccc5-n5c6ccccc6c6cccc4c65)cc3o2)cc1
• InChI: InChI=1S/C56H34N6.C48H27F4N3.C43H26N4O2.C43H26N4O.2C42H25N5O2.C42H25N5O/c57-35-37-28-39(40-29-38(36-58)31-45(33-40)61-53-23-11-12-24-54(53)62-51-22-10-7-18-46(51)48-20-13-25-55(61)56(48)62)32-44(30-37)60-50-21-9-8-19-47(50)49-34-43(26-27-52(49)60)59(41-14-3-1-4-15-41)42-16-5-2-6-17-42;49-44-42(28-20-24-30(25-21-28)53-36-14-4-1-10-32(36)33-11-2-5-15-37(33)53)45(50)47(52)43(46(44)51)29-22-26-31(27-23-29)54-39-17-7-8-18-40(39)55-38-16-6-3-12-34(38)35-13-9-19-41(54)48(35)55;1-2-12-33-30(10-1)31-11-9-17-38-42(31)47(33)35-14-4-3-13-34(35)46(38)29-24-25-32-41(26-29)49-43(44-32)27-20-22-28(23-21-27)45-36-15-5-7-18-39(36)48-40-19-8-6-16-37(40)45;1-4-14-35-30(10-1)31-11-2-5-15-36(31)45(35)28-22-20-27(21-23-28)43-44-34-25-24-29(26-41(34)48-43)46-38-17-7-8-18-39(38)47-37-16-6-3-12-32(37)33-13-9-19-40(46)42(33)47;1-2-12-32-28(10-1)29-11-9-17-37-41(29)47(32)34-14-4-3-13-33(34)45(37)26-20-22-30-40(24-26)49-42(44-30)31-23-21-27(25-43-31)46-35-15-5-7-18-38(35)48-39-19-8-6-16-36(39)46;1-2-12-31-29(10-1)30-11-9-17-36-40(30)47(31)33-14-4-3-13-32(33)46(36)28-24-39-41(43-25-28)44-42(49-39)26-20-22-27(23-21-26)45-34-15-5-7-18-37(34)48-38-19-8-6-16-35(38)45;1-4-14-33-29(10-1)30-11-2-5-15-34(30)45(33)27-22-20-26(21-23-27)42-44-41-39(48-42)24-28(25-43-41)46-36-17-7-8-18-37(36)47-35-16-6-3-12-31(35)32-13-9-19-38(46)40(32)47/h1-34H;1-27H;1-26H;1-26H;2*1-25H;1-25H
• InChIKey: HDMWPSSIPAQEFS-UHFFFAOYSA-N
• XLogP: 85.08
• TPSA: 333.96 Ų
• H-Bond Acceptors: 40
• Rotatable Bonds: 25
• Heavy Atoms: 360
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4637.19
LogP ≤ 5	85.08
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	40

Frequently Asked Questions

What is the IUPAC name of 2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine?

The IUPAC name of 2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine (CID 158446960) is 2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine.

What is the SMILES notation for 2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine?

The canonical SMILES for 2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine is Fc1c(F)c(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(F)c(F)c1-c1ccc(N2c3ccccc3-n3c4ccccc4c4cccc2c43)cc1.N#Cc1cc(-c2cc(C#N)cc(-n3c4ccccc4c4cc(N(c5ccccc5)c5ccccc5)ccc43)c2)cc(N2c3ccccc3-n3c4ccccc4c4cccc2c43)c1.c1ccc2c(c1)N(c1ccc3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)oc3c1)c1cccc3c4ccccc4n-2c13.c1ccc2c(c1)N(c1cnc3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)oc3c1)c1cccc3c4ccccc4n-2c13.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2nc3ccc(N4c5ccccc5-n5c6ccccc6c6cccc4c65)cc3o2)cc1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2nc3ccc(N4c5ccccc5-n5c6ccccc6c6cccc4c65)cc3o2)nc1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2nc3ncc(N4c5ccccc5-n5c6ccccc6c6cccc4c65)cc3o2)cc1.

What is the InChIKey of 2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine?

The InChIKey is HDMWPSSIPAQEFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H34N6.C48H27F4N3.C43H26N4O2.C43H26N4O.2C42H25N5O2.C42H25N5O/c57-35-37-28-39(40-29-38(36-58)31-45(33-40)61-53-23-11-12-24-54(53)62-51-22-10-7-18-46(51)48-20-13-25-55(61)56(48)62)32-44(30-37)60-50-21-9-8-19-47(50)49-34-43(26-27-52(49)60)59(41-14-3-1-4-15-41)42-16-5-2-6-17-42;49-44-42(28-20-24-30(25-21-28)53-36-14-4-1-10-32(36)33-11-2-5-15-37(33)53)45(50)47(52)43(46(44)51)29-22-26-31(27-23-29)54-39-17-7-8-18-40(39)55-38-16-6-3-12-34(38)35-13-9-19-41(54)48(35)55;1-2-12-33-30(10-1)31-11-9-17-38-42(31)47(33)35-14-4-3-13-34(35)46(38)29-24-25-32-41(26-29)49-43(44-32)27-20-22-28(23-21-27)45-36-15-5-7-18-39(36)48-40-19-8-6-16-37(40)45;1-4-14-35-30(10-1)31-11-2-5-15-36(31)45(35)28-22-20-27(21-23-28)43-44-34-25-24-29(26-41(34)48-43)46-38-17-7-8-18-39(38)47-37-16-6-3-12-32(37)33-13-9-19-40(46)42(33)47;1-2-12-32-28(10-1)29-11-9-17-37-41(29)47(32)34-14-4-3-13-33(34)45(37)26-20-22-30-40(24-26)49-42(44-30)31-23-21-27(25-43-31)46-35-15-5-7-18-38(35)48-39-19-8-6-16-36(39)46;1-2-12-31-29(10-1)30-11-9-17-36-40(30)47(31)33-14-4-3-13-32(33)46(36)28-24-39-41(43-25-28)44-42(49-39)26-20-22-27(23-21-26)45-34-15-5-7-18-37(34)48-38-19-8-6-16-35(38)45;1-4-14-33-29(10-1)30-11-2-5-15-34(30)45(33)27-22-20-26(21-23-27)42-44-41-39(48-42)24-28(25-43-41)46-36-17-7-8-18-37(36)47-35-16-6-3-12-31(35)32-13-9-19-38(46)40(32)47/h1-34H;1-27H;1-26H;1-26H;2*1-25H;1-25H.

What are the key properties of 2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine?

2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine has a molecular weight of 4637.19 g/mol, XLogP of 85.08, 25 rotatable bonds, 0 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazole;2-(4-carbazol-9-ylphenyl)-6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridine;13-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetrafluorophenyl]phenyl]-1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;3-[3-cyano-5-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)phenyl]-5-[3-(N-phenylanilino)carbazol-9-yl]benzonitrile;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]phenyl]phenoxazine;10-[6-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-1,3-benzoxazol-2-yl]-3-pyridinyl]phenoxazine;10-[4-[6-(1,13-diazapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-13-yl)-[1,3]oxazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine is sourced from PubChem (CID 158446960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).