9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile

C426H248N40O2S6 — CID 158684962

About 9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile

9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile (PubChem CID 158684962) has the molecular formula C426H248N40O2S6 and a molecular weight of 6151.35 g/mol. Its IUPAC name is 9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile.

Molecular Properties

• Compound Name: 9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile
• PubChem CID: 158684962
• Molecular Formula: C426H248N40O2S6
• Molecular Weight: 6151.35 g/mol
• Exact Mass: 6145.89
• IUPAC Name: 9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile
• SMILES: N#Cc1c(-c2ccc3c(c2)C2(c4ccccc4S3)c3cccnc3-c3ncccc32)cc(-n2c3ccccc3c3ccccc32)cc1-n1c2ccccc2c2ccccc21.N#Cc1cc(-n2c3ccccc3c3ccccc32)cc(-c2ccc3c(c2)C2(c4ccccc4S3)c3cccnc3-c3ncccc32)c1-n1c2ccccc2c2ccccc21.N#Cc1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccc3c(c2)C2(c4ccccc4S3)c3cccnc3-c3ncccc32)cc(-n2c3ccccc3c3ccccc32)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc3c(c2)C2(c4ccccc4S3)c3cccnc3-c3ncccc32)cc1-n1c2ccccc2c2ccccc21.N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-n2c3ccccc3c3ccccc32)cc1-c1ccc2c(c1)C1(c3ccccc3S2)c2cccnc2-c2ncccc21.c1ccc2c(c1)Oc1ccc(-c3cc(-n4c5ccccc5c5ccccc54)ncc3-n3c4ccccc4c4ccccc43)cc1C21c2cccnc2-c2ncccc21.c1ccc2c(c1)Oc1ccc(-c3nc(-n4c5ccccc5c5ccccc54)ccc3-n3c4ccccc4c4ccccc43)cc1C21c2cccnc2-c2ncccc21.c1ccc2c(c1)Sc1ccc(-c3cc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)c3)cc1C21c2cccnc2-c2ncccc21
• InChI: InChI=1S/5C54H31N5S.2C52H31N5O.C52H31N5S/c55-32-34-29-35(58-45-20-6-1-13-36(45)37-14-2-7-21-46(37)58)31-40(53(34)59-47-22-8-3-15-38(47)39-16-4-9-23-48(39)59)33-25-26-50-44(30-33)54(41-17-5-10-24-49(41)60-50)42-18-11-27-56-51(42)52-43(54)19-12-28-57-52;55-32-40-39(33-25-26-51-44(29-33)54(41-17-5-10-24-50(41)60-51)42-18-11-27-56-52(42)53-43(54)19-12-28-57-53)30-34(58-45-20-6-1-13-35(45)36-14-2-7-21-46(36)58)31-49(40)59-47-22-8-3-15-37(47)38-16-4-9-23-48(38)59;55-32-33-21-24-49-40(29-33)38-13-3-7-19-47(38)59(49)48-25-23-35(58-45-17-5-1-11-36(45)37-12-2-6-18-46(37)58)31-39(48)34-22-26-51-44(30-34)54(41-14-4-8-20-50(41)60-51)42-15-9-27-56-52(42)53-43(54)16-10-28-57-53;55-32-33-21-24-47-39(29-33)38-13-3-7-19-46(38)58(47)48-25-22-35(31-49(48)59-44-17-5-1-11-36(44)37-12-2-6-18-45(37)59)34-23-26-51-43(30-34)54(40-14-4-8-20-50(40)60-51)41-15-9-27-56-52(41)53-42(54)16-10-28-57-53;55-32-33-21-23-49-41(27-33)40-13-3-7-19-48(40)59(49)37-29-35(28-36(31-37)58-46-17-5-1-11-38(46)39-12-2-6-18-47(39)58)34-22-24-51-45(30-34)54(42-14-4-8-20-50(42)60-51)43-15-9-25-56-52(43)53-44(54)16-10-26-57-53;1-6-20-41-33(13-1)34-14-2-7-21-42(34)56(41)45-26-28-48(57-43-22-8-3-15-35(43)36-16-4-9-23-44(36)57)55-49(45)32-25-27-47-40(31-32)52(37-17-5-10-24-46(37)58-47)38-18-11-29-53-50(38)51-39(52)19-12-30-54-51;1-6-20-42-33(13-1)34-14-2-7-21-43(34)56(42)46-31-55-49(57-44-22-8-3-15-35(44)36-16-4-9-23-45(36)57)30-37(46)32-25-26-48-41(29-32)52(38-17-5-10-24-47(38)58-48)39-18-11-27-53-50(39)51-40(52)19-12-28-54-51;1-6-20-42-34(13-1)35-14-2-7-21-43(35)56(42)48-30-33(31-49(55-48)57-44-22-8-3-15-36(44)37-16-4-9-23-45(37)57)32-25-26-47-41(29-32)52(38-17-5-10-24-46(38)58-47)39-18-11-27-53-50(39)51-40(52)19-12-28-54-51/h5*1-31H;3*1-31H
• InChIKey: IFPSNGULVYTMEE-UHFFFAOYSA-N
• XLogP: 102.15
• TPSA: 461.20 Ų
• H-Bond Acceptors: 48
• Rotatable Bonds: 24
• Heavy Atoms: 474
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	6151.35
LogP ≤ 5	102.15
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	48

Frequently Asked Questions

What is the IUPAC name of 9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile?

The IUPAC name of 9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile (CID 158684962) is 9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile.

What is the SMILES notation for 9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile?

The canonical SMILES for 9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile is N#Cc1c(-c2ccc3c(c2)C2(c4ccccc4S3)c3cccnc3-c3ncccc32)cc(-n2c3ccccc3c3ccccc32)cc1-n1c2ccccc2c2ccccc21.N#Cc1cc(-n2c3ccccc3c3ccccc32)cc(-c2ccc3c(c2)C2(c4ccccc4S3)c3cccnc3-c3ncccc32)c1-n1c2ccccc2c2ccccc21.N#Cc1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccc3c(c2)C2(c4ccccc4S3)c3cccnc3-c3ncccc32)cc(-n2c3ccccc3c3ccccc32)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc3c(c2)C2(c4ccccc4S3)c3cccnc3-c3ncccc32)cc1-n1c2ccccc2c2ccccc21.N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-n2c3ccccc3c3ccccc32)cc1-c1ccc2c(c1)C1(c3ccccc3S2)c2cccnc2-c2ncccc21.c1ccc2c(c1)Oc1ccc(-c3cc(-n4c5ccccc5c5ccccc54)ncc3-n3c4ccccc4c4ccccc43)cc1C21c2cccnc2-c2ncccc21.c1ccc2c(c1)Oc1ccc(-c3nc(-n4c5ccccc5c5ccccc54)ccc3-n3c4ccccc4c4ccccc43)cc1C21c2cccnc2-c2ncccc21.c1ccc2c(c1)Sc1ccc(-c3cc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)c3)cc1C21c2cccnc2-c2ncccc21.

What is the InChIKey of 9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile?

The InChIKey is IFPSNGULVYTMEE-UHFFFAOYSA-N. The full InChI is InChI=1S/5C54H31N5S.2C52H31N5O.C52H31N5S/c55-32-34-29-35(58-45-20-6-1-13-36(45)37-14-2-7-21-46(37)58)31-40(53(34)59-47-22-8-3-15-38(47)39-16-4-9-23-48(39)59)33-25-26-50-44(30-33)54(41-17-5-10-24-49(41)60-50)42-18-11-27-56-51(42)52-43(54)19-12-28-57-52;55-32-40-39(33-25-26-51-44(29-33)54(41-17-5-10-24-50(41)60-51)42-18-11-27-56-52(42)53-43(54)19-12-28-57-53)30-34(58-45-20-6-1-13-35(45)36-14-2-7-21-46(36)58)31-49(40)59-47-22-8-3-15-37(47)38-16-4-9-23-48(38)59;55-32-33-21-24-49-40(29-33)38-13-3-7-19-47(38)59(49)48-25-23-35(58-45-17-5-1-11-36(45)37-12-2-6-18-46(37)58)31-39(48)34-22-26-51-44(30-34)54(41-14-4-8-20-50(41)60-51)42-15-9-27-56-52(42)53-43(54)16-10-28-57-53;55-32-33-21-24-47-39(29-33)38-13-3-7-19-46(38)58(47)48-25-22-35(31-49(48)59-44-17-5-1-11-36(44)37-12-2-6-18-45(37)59)34-23-26-51-43(30-34)54(40-14-4-8-20-50(40)60-51)41-15-9-27-56-52(41)53-42(54)16-10-28-57-53;55-32-33-21-23-49-41(27-33)40-13-3-7-19-48(40)59(49)37-29-35(28-36(31-37)58-46-17-5-1-11-38(46)39-12-2-6-18-47(39)58)34-22-24-51-45(30-34)54(42-14-4-8-20-50(42)60-51)43-15-9-25-56-52(43)53-44(54)16-10-26-57-53;1-6-20-41-33(13-1)34-14-2-7-21-42(34)56(41)45-26-28-48(57-43-22-8-3-15-35(43)36-16-4-9-23-44(36)57)55-49(45)32-25-27-47-40(31-32)52(37-17-5-10-24-46(37)58-47)38-18-11-29-53-50(38)51-39(52)19-12-30-54-51;1-6-20-42-33(13-1)34-14-2-7-21-43(34)56(42)46-31-55-49(57-44-22-8-3-15-35(44)36-16-4-9-23-45(36)57)30-37(46)32-25-26-48-41(29-32)52(38-17-5-10-24-47(38)58-48)39-18-11-27-53-50(39)51-40(52)19-12-28-54-51;1-6-20-42-34(13-1)35-14-2-7-21-43(35)56(42)48-30-33(31-49(55-48)57-44-22-8-3-15-36(44)37-16-4-9-23-45(37)57)32-25-26-47-41(29-32)52(38-17-5-10-24-46(38)58-47)39-18-11-27-53-50(39)51-40(52)19-12-28-54-51/h5*1-31H;3*1-31H.

What are the key properties of 9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile?

9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile has a molecular weight of 6151.35 g/mol, XLogP of 102.15, 24 rotatable bonds, 0 hydrogen bond donors, and 48 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(2-carbazol-9-yl-4-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(3-carbazol-9-yl-5-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;9-(4-carbazol-9-yl-2-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylphenyl)carbazole-3-carbonitrile;2'-[2,6-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene];2'-[2,5-di(carbazol-9-yl)-4-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2'-[3,6-di(carbazol-9-yl)-2-pyridinyl]spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-xanthene];2,4-di(carbazol-9-yl)-6-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile;2,5-di(carbazol-9-yl)-3-spiro[3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-8,9'-thioxanthene]-2'-ylbenzonitrile is sourced from PubChem (CID 158684962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).