(7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane

C201H124N6O2S5Si3 — CID 157160968

About (7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane

(7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane (PubChem CID 157160968) has the molecular formula C201H124N6O2S5Si3 and a molecular weight of 2899.84 g/mol. Its IUPAC name is (7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane.

Molecular Properties

• Compound Name: (7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane
• PubChem CID: 157160968
• Molecular Formula: C201H124N6O2S5Si3
• Molecular Weight: 2899.84 g/mol
• Exact Mass: 2896.77
• IUPAC Name: (7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane
• SMILES: c1ccc([Si](c2ccccc2)(c2ccc3c(c2)-c2ccccc2-c2ccccc2-c2cc(-c4cccc5c4sc4ccccc45)ccc2-3)c2cc3c(o2)-c2cccnc2-c2ncccc2-c2sccc2-3)cc1.c1ccc([Si](c2ccccc2)(c2ccc3c(c2)-c2ccccc2-c2ccccc2-c2cc(-c4cccc5c4sc4ccccc45)ccc2-3)c2cc3c(s2)-c2cccnc2-c2ccccc2-c2ccccc2-3)cc1.c1ccc([Si](c2ccccc2)(c2ccc3c(c2)-c2ccccc2-c2ccccc2-c2cc(-n4c5ccccc5c5ccccc54)ccc2-3)c2cc3c(s2)-c2cccnc2-c2ncccc2-c2occc2-3)cc1
• InChI: InChI=1S/C69H43NS2Si.C66H41N3OSSi.C66H40N2OS2Si/c1-3-19-45(20-4-1)73(46-21-5-2-6-22-46,66-43-64-55-29-12-9-25-51(55)52-26-13-14-31-59(52)67-61(69(64)72-66)34-18-40-70-67)47-37-39-57-56-38-36-44(48-32-17-33-60-58-30-15-16-35-65(58)71-68(48)60)41-62(56)53-27-10-7-23-49(53)50-24-8-11-28-54(50)63(57)42-47;1-3-17-43(18-4-1)72(44-19-5-2-6-20-44,62-41-59-54-35-38-70-65(54)55-27-15-36-67-63(55)64-56(66(59)71-62)28-16-37-68-64)45-32-34-51-50-33-31-42(69-60-29-13-11-25-52(60)53-26-12-14-30-61(53)69)39-57(50)48-23-9-7-21-46(48)47-22-8-10-24-49(47)58(51)40-45;1-3-16-42(17-4-1)72(43-18-5-2-6-19-43,61-40-59-54-34-37-70-65(54)56-28-15-36-68-63(56)62-55(64(59)69-61)27-14-35-67-62)44-31-33-51-50-32-30-41(45-25-13-26-53-52-24-11-12-29-60(52)71-66(45)53)38-57(50)48-22-9-7-20-46(48)47-21-8-10-23-49(47)58(51)39-44/h1-43H;1-41H;1-40H/b50-49-,52-51-,57-56-,62-53-,63-54-,64-55-,67-59+,69-61+;47-46-,51-50-,57-48-,58-49-,59-54-,64-63-,65-55+,66-56+;47-46-,51-50-,57-48-,58-49-,59-54-,63-62-,64-55+,65-56+
• InChIKey: AMJHTERVNZJBKP-KWNBHZEPSA-N
• XLogP: 46.59
• TPSA: 95.66 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 15
• Heavy Atoms: 217
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2899.84
LogP ≤ 5	46.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane?

The IUPAC name of (7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane (CID 157160968) is (7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane.

What is the SMILES notation for (7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane?

The canonical SMILES for (7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane is c1ccc([Si](c2ccccc2)(c2ccc3c(c2)-c2ccccc2-c2ccccc2-c2cc(-c4cccc5c4sc4ccccc45)ccc2-3)c2cc3c(o2)-c2cccnc2-c2ncccc2-c2sccc2-3)cc1.c1ccc([Si](c2ccccc2)(c2ccc3c(c2)-c2ccccc2-c2ccccc2-c2cc(-c4cccc5c4sc4ccccc45)ccc2-3)c2cc3c(s2)-c2cccnc2-c2ccccc2-c2ccccc2-3)cc1.c1ccc([Si](c2ccccc2)(c2ccc3c(c2)-c2ccccc2-c2ccccc2-c2cc(-n4c5ccccc5c5ccccc54)ccc2-3)c2cc3c(s2)-c2cccnc2-c2ncccc2-c2occc2-3)cc1.

What is the InChIKey of (7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane?

The InChIKey is AMJHTERVNZJBKP-KWNBHZEPSA-N. The full InChI is InChI=1S/C69H43NS2Si.C66H41N3OSSi.C66H40N2OS2Si/c1-3-19-45(20-4-1)73(46-21-5-2-6-22-46,66-43-64-55-29-12-9-25-51(55)52-26-13-14-31-59(52)67-61(69(64)72-66)34-18-40-70-67)47-37-39-57-56-38-36-44(48-32-17-33-60-58-30-15-16-35-65(58)71-68(48)60)41-62(56)53-27-10-7-23-49(53)50-24-8-11-28-54(50)63(57)42-47;1-3-17-43(18-4-1)72(44-19-5-2-6-20-44,62-41-59-54-35-38-70-65(54)55-27-15-36-67-63(55)64-56(66(59)71-62)28-16-37-68-64)45-32-34-51-50-33-31-42(69-60-29-13-11-25-52(60)53-26-12-14-30-61(53)69)39-57(50)48-23-9-7-21-46(48)47-22-8-10-24-49(47)58(51)40-45;1-3-16-42(17-4-1)72(43-18-5-2-6-19-43,61-40-59-54-34-37-70-65(54)56-28-15-36-68-63(56)62-55(64(59)69-61)27-14-35-67-62)44-31-33-51-50-32-30-41(45-25-13-26-53-52-24-11-12-29-60(52)71-66(45)53)38-57(50)48-22-9-7-20-46(48)47-21-8-10-23-49(47)58(51)39-44/h1-43H;1-41H;1-40H/b50-49-,52-51-,57-56-,62-53-,63-54-,64-55-,67-59+,69-61+;47-46-,51-50-,57-48-,58-49-,59-54-,64-63-,65-55+,66-56+;47-46-,51-50-,57-48-,58-49-,59-54-,63-62-,64-55+,65-56+.

What are the key properties of (7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane?

(7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane has a molecular weight of 2899.84 g/mol, XLogP of 46.59, 15 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for (7-carbazol-9-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-9-yl)-diphenylsilane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-diphenyl-(3-thia-20-azapentacyclo[17.4.0.02,6.07,12.013,18]tricosa-1(19),2(6),4,7,9,11,13,15,17,20,22-undecaen-4-yl)silane;(7-dibenzothiophen-4-yltetraphenylen-2-yl)-(3-oxa-10-thia-16,19-diazapentacyclo[16.4.0.02,6.07,11.012,17]docosa-1(18),2(6),4,7(11),8,12(17),13,15,19,21-decaen-4-yl)-diphenylsilane is sourced from PubChem (CID 157160968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).