2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide

C186H122N16O7S4 — CID 159570106

About 2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide

2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide (PubChem CID 159570106) has the molecular formula C186H122N16O7S4 and a molecular weight of 2821.39 g/mol. Its IUPAC name is 2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide.

Molecular Properties

• Compound Name: 2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide
• PubChem CID: 159570106
• Molecular Formula: C186H122N16O7S4
• Molecular Weight: 2821.39 g/mol
• Exact Mass: 2818.86
• IUPAC Name: 2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide
• SMILES: CC1(C)c2cc(-c3ccc4c(c3)c3ccc5c6ccccc6n(-c6ccccc6)c5c3n4-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21.CC1(C)c2cc(-c3ccc4c(c3)c3ccc5c6ccccc6oc5c3n4-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21.CC1(C)c2cc(-c3ccc4c(c3)c3ccc5c6ccccc6sc5c3n4-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21
• InChI: InChI=1S/C66H44N6O2S.C60H39N5O3S.C60H39N5O2S2/c1-66(2)53-39-44(31-36-59(53)75(73,74)60-37-32-46(40-54(60)66)70-55-27-15-12-24-47(55)48-25-13-16-28-56(48)70)43-30-35-58-52(38-43)51-34-33-50-49-26-14-17-29-57(49)71(45-22-10-5-11-23-45)61(50)62(51)72(58)65-68-63(41-18-6-3-7-19-41)67-64(69-65)42-20-8-4-9-21-42;2*1-60(2)47-34-39(26-31-53(47)69(66,67)54-32-27-40(35-48(54)60)64-49-22-12-9-19-41(49)42-20-10-13-23-50(42)64)38-25-30-51-46(33-38)44-28-29-45-43-21-11-14-24-52(43)68-56(45)55(44)65(51)59-62-57(36-15-5-3-6-16-36)61-58(63-59)37-17-7-4-8-18-37/h3-40H,1-2H3;2*3-35H,1-2H3
• InChIKey: MHRXTYFSUACRSK-UHFFFAOYSA-N
• XLogP: 44.98
• TPSA: 266.08 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 16
• Heavy Atoms: 213
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2821.39
LogP ≤ 5	44.98
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide?

The IUPAC name of 2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide (CID 159570106) is 2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide.

What is the SMILES notation for 2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide?

The canonical SMILES for 2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide is CC1(C)c2cc(-c3ccc4c(c3)c3ccc5c6ccccc6n(-c6ccccc6)c5c3n4-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21.CC1(C)c2cc(-c3ccc4c(c3)c3ccc5c6ccccc6oc5c3n4-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21.CC1(C)c2cc(-c3ccc4c(c3)c3ccc5c6ccccc6sc5c3n4-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21.

What is the InChIKey of 2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide?

The InChIKey is MHRXTYFSUACRSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H44N6O2S.C60H39N5O3S.C60H39N5O2S2/c1-66(2)53-39-44(31-36-59(53)75(73,74)60-37-32-46(40-54(60)66)70-55-27-15-12-24-47(55)48-25-13-16-28-56(48)70)43-30-35-58-52(38-43)51-34-33-50-49-26-14-17-29-57(49)71(45-22-10-5-11-23-45)61(50)62(51)72(58)65-68-63(41-18-6-3-7-19-41)67-64(69-65)42-20-8-4-9-21-42;2*1-60(2)47-34-39(26-31-53(47)69(66,67)54-32-27-40(35-48(54)60)64-49-22-12-9-19-41(49)42-20-10-13-23-50(42)64)38-25-30-51-46(33-38)44-28-29-45-43-21-11-14-24-52(43)68-56(45)55(44)65(51)59-62-57(36-15-5-3-6-16-36)61-58(63-59)37-17-7-4-8-18-37/h3-40H,1-2H3;2*3-35H,1-2H3.

What are the key properties of 2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide?

2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide has a molecular weight of 2821.39 g/mol, XLogP of 44.98, 16 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide;2-carbazol-9-yl-7-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazol-3-yl]-9,9-dimethylthioxanthene 10,10-dioxide is sourced from PubChem (CID 159570106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).