14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]

C329H220N12S13 — CID 158383522

About 14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]

14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene] (PubChem CID 158383522) has the molecular formula C329H220N12S13 and a molecular weight of 4758.33 g/mol. Its IUPAC name is 14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene].

Molecular Properties

• Compound Name: 14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]
• PubChem CID: 158383522
• Molecular Formula: C329H220N12S13
• Molecular Weight: 4758.33 g/mol
• Exact Mass: 4753.40
• IUPAC Name: 14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]
• SMILES: CC1(C)c2ccccc2-c2cc3c(cc21)N(c1cc2c(c4ccccc14)-c1ccccc1C2(C)C)c1ccccc1C31c2ccsc2-c2sccc21.CC1(C)c2ccccc2-c2cc3c(cc21)N(c1ccc2c(c1)c1ccccc1n2-c1ccccc1)c1ccccc1C31c2ccsc2-c2sccc21.CC1(C)c2ccccc2-c2cc3c(cc21)N(c1ccc2sc4ccc(-n5c6ccccc6c6ccccc65)cc4c2c1)c1ccccc1C31c2ccsc2-c2sccc21.CC1(C)c2ccccc2-c2cc3c(cc21)N(c1cccc(-c2cc(-c4ccccc4)nc(-c4ccccc4)c2)c1)c1ccccc1C31c2ccsc2-c2sccc21.CC1(C)c2ccccc2-c2cc3c(cc21)N(c1cccc(-c2cc(-c4ccccc4)nc(-c4ccccc4)n2)c1)c1ccccc1C31c2ccsc2-c2sccc21.CC1(C)c2ccccc2-c2cc3c(cc21)N(c1cccc(N(c2ccc(-c4ccccc4)cc2)c2ccc4c(c2)C2(c5ccccc5-c5ccccc52)c2ccccc2-4)c1)c1ccccc1C31c2ccsc2-c2sccc21
• InChI: InChI=1S/C73H48N2S2.C54H34N2S3.C53H36N2S2.C52H35N3S2.C49H35NS2.C48H32N2S2/c1-71(2)57-25-10-6-24-54(57)56-43-66-68(44-64(56)71)75(67-30-15-14-29-61(67)73(66)62-37-39-76-69(62)70-63(73)38-40-77-70)49-20-16-19-48(41-49)74(47-33-31-46(32-34-47)45-17-4-3-5-18-45)50-35-36-55-53-23-9-13-28-60(53)72(65(55)42-50)58-26-11-7-21-51(58)52-22-8-12-27-59(52)72;1-53(2)39-14-6-3-11-33(39)36-29-44-48(30-43(36)53)56(47-18-10-7-15-40(47)54(44)41-23-25-57-51(41)52-42(54)24-26-58-52)32-20-22-50-38(28-32)37-27-31(19-21-49(37)59-50)55-45-16-8-4-12-34(45)35-13-5-9-17-46(35)55;1-52(2)40-21-10-9-20-38(40)39-31-45-49(32-44(39)52)55(48-23-12-11-22-41(48)53(45)42-24-26-56-50(42)51-43(53)25-27-57-51)37-19-13-18-35(28-37)36-29-46(33-14-5-3-6-15-33)54-47(30-36)34-16-7-4-8-17-34;1-51(2)38-21-10-9-20-36(38)37-29-43-47(30-42(37)51)55(46-23-12-11-22-39(46)52(43)40-24-26-56-48(40)49-41(52)25-27-57-49)35-19-13-18-34(28-35)45-31-44(32-14-5-3-6-15-32)53-50(54-45)33-16-7-4-8-17-33;1-47(2)33-17-9-7-13-28(33)32-25-39-43(26-38(32)47)50(41-20-12-11-19-35(41)49(39)36-21-23-51-45(36)46-37(49)22-24-52-46)42-27-40-44(30-15-6-5-14-29(30)42)31-16-8-10-18-34(31)48(40,3)4;1-47(2)35-16-8-6-14-31(35)33-27-40-44(28-39(33)47)50(43-19-11-9-17-36(43)48(40)37-22-24-51-45(37)46-38(48)23-25-52-46)30-20-21-42-34(26-30)32-15-7-10-18-41(32)49(42)29-12-4-3-5-13-29/h3-44H,1-2H3;3-30H,1-2H3;3-32H,1-2H3;3-31H,1-2H3;5-27H,1-4H3;3-28H,1-2H3
• InChIKey: GWBZEELQWMYSCC-UHFFFAOYSA-N
• XLogP: 91.26
• TPSA: 71.21 Ų
• H-Bond Acceptors: 25
• Rotatable Bonds: 18
• Heavy Atoms: 354
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4758.33
LogP ≤ 5	91.26
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of 14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]?

The IUPAC name of 14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene] (CID 158383522) is 14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene].

What is the SMILES notation for 14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]?

The canonical SMILES for 14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene] is CC1(C)c2ccccc2-c2cc3c(cc21)N(c1cc2c(c4ccccc14)-c1ccccc1C2(C)C)c1ccccc1C31c2ccsc2-c2sccc21.CC1(C)c2ccccc2-c2cc3c(cc21)N(c1ccc2c(c1)c1ccccc1n2-c1ccccc1)c1ccccc1C31c2ccsc2-c2sccc21.CC1(C)c2ccccc2-c2cc3c(cc21)N(c1ccc2sc4ccc(-n5c6ccccc6c6ccccc65)cc4c2c1)c1ccccc1C31c2ccsc2-c2sccc21.CC1(C)c2ccccc2-c2cc3c(cc21)N(c1cccc(-c2cc(-c4ccccc4)nc(-c4ccccc4)c2)c1)c1ccccc1C31c2ccsc2-c2sccc21.CC1(C)c2ccccc2-c2cc3c(cc21)N(c1cccc(-c2cc(-c4ccccc4)nc(-c4ccccc4)n2)c1)c1ccccc1C31c2ccsc2-c2sccc21.CC1(C)c2ccccc2-c2cc3c(cc21)N(c1cccc(N(c2ccc(-c4ccccc4)cc2)c2ccc4c(c2)C2(c5ccccc5-c5ccccc52)c2ccccc2-4)c1)c1ccccc1C31c2ccsc2-c2sccc21.

What is the InChIKey of 14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]?

The InChIKey is GWBZEELQWMYSCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H48N2S2.C54H34N2S3.C53H36N2S2.C52H35N3S2.C49H35NS2.C48H32N2S2/c1-71(2)57-25-10-6-24-54(57)56-43-66-68(44-64(56)71)75(67-30-15-14-29-61(67)73(66)62-37-39-76-69(62)70-63(73)38-40-77-70)49-20-16-19-48(41-49)74(47-33-31-46(32-34-47)45-17-4-3-5-18-45)50-35-36-55-53-23-9-13-28-60(53)72(65(55)42-50)58-26-11-7-21-51(58)52-22-8-12-27-59(52)72;1-53(2)39-14-6-3-11-33(39)36-29-44-48(30-43(36)53)56(47-18-10-7-15-40(47)54(44)41-23-25-57-51(41)52-42(54)24-26-58-52)32-20-22-50-38(28-32)37-27-31(19-21-49(37)59-50)55-45-16-8-4-12-34(45)35-13-5-9-17-46(35)55;1-52(2)40-21-10-9-20-38(40)39-31-45-49(32-44(39)52)55(48-23-12-11-22-41(48)53(45)42-24-26-56-50(42)51-43(53)25-27-57-51)37-19-13-18-35(28-37)36-29-46(33-14-5-3-6-15-33)54-47(30-36)34-16-7-4-8-17-34;1-51(2)38-21-10-9-20-36(38)37-29-43-47(30-42(37)51)55(46-23-12-11-22-39(46)52(43)40-24-26-56-48(40)49-41(52)25-27-57-49)35-19-13-18-34(28-35)45-31-44(32-14-5-3-6-15-32)53-50(54-45)33-16-7-4-8-17-33;1-47(2)33-17-9-7-13-28(33)32-25-39-43(26-38(32)47)50(41-20-12-11-19-35(41)49(39)36-21-23-51-45(36)46-37(49)22-24-52-46)42-27-40-44(30-15-6-5-14-29(30)42)31-16-8-10-18-34(31)48(40,3)4;1-47(2)35-16-8-6-14-31(35)33-27-40-44(28-39(33)47)50(43-19-11-9-17-36(43)48(40)37-22-24-51-45(37)46-38(48)23-25-52-46)30-20-21-42-34(26-30)32-15-7-10-18-41(32)49(42)29-12-4-3-5-13-29/h3-44H,1-2H3;3-30H,1-2H3;3-32H,1-2H3;3-31H,1-2H3;5-27H,1-4H3;3-28H,1-2H3.

What are the key properties of 14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]?

14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene] has a molecular weight of 4758.33 g/mol, XLogP of 91.26, 18 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 14-(8-carbazol-9-yldibenzothiophen-2-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-(7,7-dimethylbenzo[c]fluoren-5-yl)-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];10,10-dimethyl-14-(9-phenylcarbazol-3-yl)spiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];N-[3-(10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]-14-yl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;14-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene];14-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-10,10-dimethylspiro[14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-21,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene] is sourced from PubChem (CID 158383522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).