11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane

C145H92N10OS2Si — CID 165064672

IUPAC11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane
SMILESc1ccc(-c2ccc3c(c2)c2cc4sc5ccccc5c4cc2n3-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cc4sc5ccccc5c4cc2n3-c2cccc(-c3nc(-c4ccccc4)c4ccccc4n3)c2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc5c5cc6oc7ccccc7c6cc54)c3)nc3ccccc23)cc1
InChIInChI=1S/C56H37N3OSi.C45H28N4S.C44H27N3S/c1-5-18-38(19-6-1)55-46-29-13-15-30-50(46)57-56(58-55)39-20-17-21-40(34-39)59-51-33-32-44(35-47(51)48-37-54-49(36-52(48)59)45-28-14-16-31-53(45)60-54)61(41-22-7-2-8-23-41,42-24-9-3-10-25-42)43-26-11-4-12-27-43;1-4-12-29(13-5-1)33-22-25-39-36(26-33)37-28-42-38(35-18-10-11-19-41(35)50-42)27-40(37)49(39)34-23-20-32(21-24-34)45-47-43(30-14-6-2-7-15-30)46-44(48-45)31-16-8-3-9-17-31;1-3-12-28(13-4-1)30-22-23-39-35(25-30)36-27-42-37(33-18-8-10-21-41(33)48-42)26-40(36)47(39)32-17-11-16-31(24-32)44-45-38-20-9-7-19-34(38)43(46-44)29-14-5-2-6-15-29/h1-37H;1-28H;1-27H
InChIKeyRTQTUBGKCPRFDA-UHFFFAOYSA-N
MW2082.62 g/mol
LogP35.44
Rot. Bonds16

About 11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane

11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane (PubChem CID 165064672) has the molecular formula C145H92N10OS2Si and a molecular weight of 2082.62 g/mol. Its IUPAC name is 11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane.

Molecular Properties

Compound Name11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane
PubChem CID165064672
Molecular FormulaC145H92N10OS2Si
Molecular Weight2082.62 g/mol
Exact Mass2080.67
IUPAC Name11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane
SMILESc1ccc(-c2ccc3c(c2)c2cc4sc5ccccc5c4cc2n3-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cc4sc5ccccc5c4cc2n3-c2cccc(-c3nc(-c4ccccc4)c4ccccc4n3)c2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc5c5cc6oc7ccccc7c6cc54)c3)nc3ccccc23)cc1
InChIInChI=1S/C56H37N3OSi.C45H28N4S.C44H27N3S/c1-5-18-38(19-6-1)55-46-29-13-15-30-50(46)57-56(58-55)39-20-17-21-40(34-39)59-51-33-32-44(35-47(51)48-37-54-49(36-52(48)59)45-28-14-16-31-53(45)60-54)61(41-22-7-2-8-23-41,42-24-9-3-10-25-42)43-26-11-4-12-27-43;1-4-12-29(13-5-1)33-22-25-39-36(26-33)37-28-42-38(35-18-10-11-19-41(35)50-42)27-40(37)49(39)34-23-20-32(21-24-34)45-47-43(30-14-6-2-7-15-30)46-44(48-45)31-16-8-3-9-17-31;1-3-12-28(13-4-1)30-22-23-39-35(25-30)36-27-42-37(33-18-8-10-21-41(33)48-42)26-40(36)47(39)32-17-11-16-31(24-32)44-45-38-20-9-7-19-34(38)43(46-44)29-14-5-2-6-15-29/h1-37H;1-28H;1-27H
InChIKeyRTQTUBGKCPRFDA-UHFFFAOYSA-N
XLogP35.44
TPSA118.16 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds16
Heavy Atoms159
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002082.62
LogP ≤ 535.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

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

Analyze 11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane with MolForge

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Related Compounds

8-phenyl-11-[4-(4-phenylphenyl)quinazolin-2-yl]-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[4-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[4-(4-phenylphenyl)quinazolin-2-yl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane
CID 158031511
11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazole;11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazole;11-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole
CID 159253152
[12-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-a]carbazol-3-yl]-triphenylsilane;[12-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-a]carbazol-3-yl]-triphenylsilane;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-[1]benzothiolo[2,3-a]carbazole;12-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenyl-[1]benzofuro[2,3-a]carbazole;3-phenyl-12-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-[1]benzothiolo[2,3-a]carbazole;3-phenyl-12-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[2,3-a]carbazole;triphenyl-[12-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-a]carbazol-3-yl]silane;triphenyl-[12-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[2,3-a]carbazol-3-yl]silane
CID 165034267
3-dibenzofuran-2-yl-9-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]carbazole;3-dibenzofuran-2-yl-9-[3-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]phenyl]carbazole;9-(4-dibenzofuran-4-ylphenyl)-3-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]carbazole;3-dibenzofuran-2-yl-9-[3-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]phenyl]carbazole;3-dibenzofuran-2-yl-9-[4-[8-(4-phenylquinazolin-2-yl)dibenzofuran-2-yl]phenyl]carbazole
CID 159742632
11-[4-[2-[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-4-[4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole
CID 126630887
11-[3-[4-[3-([1]benzothiolo[3,2-b]carbazol-11-yl)phenyl]-6-[4-([1]benzothiolo[3,2-b]carbazol-11-yl)phenyl]quinazolin-2-yl]phenyl]-[1]benzothiolo[3,2-b]carbazole
CID 126630744
12-[4-(4-dibenzofuran-3-ylquinazolin-2-yl)phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[4-(4-dibenzothiophen-3-ylquinazolin-2-yl)phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12-[3-[4-(4-phenylphenyl)quinazolin-2-yl]phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 158448902
11-[3-[4-[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-6-[4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-2-yl]phenyl]-[1]benzofuro[3,2-b]carbazole
CID 126630945
[4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-diphenyl-[3-(9-phenylcarbazol-3-yl)phenyl]silane;diphenyl-[3-(9-phenylcarbazol-3-yl)phenyl]-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane;diphenyl-[4-(9-phenylcarbazol-3-yl)phenyl]-[4-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane
CID 158196682
11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazole
CID 126580313
4-[4-([1]benzothiolo[3,2-b]carbazol-11-yl)-6-phenyl-1,3,5-triazin-2-yl]benzonitrile;11-[3-[4-(3-isocyanophenyl)quinazolin-2-yl]phenyl]-[1]benzofuro[3,2-b]carbazole;11-[3-[4-(4-isocyanophenyl)quinazolin-2-yl]phenyl]-[1]benzothiolo[3,2-b]carbazole
CID 161361978
2-[4-carbazol-9-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-7-(3-phenylphenyl)-[1]benzofuro[2,3-b]carbazole;2-[4-dibenzofuran-2-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]-7-phenyl-[1]benzofuro[2,3-b]carbazole;2-[4-dibenzofuran-2-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-7-phenyl-[1]benzofuro[2,3-b]carbazole;2-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 163669765

Frequently Asked Questions

What is the IUPAC name of 11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane?
The IUPAC name of 11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane (CID 165064672) is 11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane.
What is the SMILES notation for 11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane?
The canonical SMILES for 11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane is c1ccc(-c2ccc3c(c2)c2cc4sc5ccccc5c4cc2n3-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cc4sc5ccccc5c4cc2n3-c2cccc(-c3nc(-c4ccccc4)c4ccccc4n3)c2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc5c5cc6oc7ccccc7c6cc54)c3)nc3ccccc23)cc1.
What is the InChIKey of 11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane?
The InChIKey is RTQTUBGKCPRFDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H37N3OSi.C45H28N4S.C44H27N3S/c1-5-18-38(19-6-1)55-46-29-13-15-30-50(46)57-56(58-55)39-20-17-21-40(34-39)59-51-33-32-44(35-47(51)48-37-54-49(36-52(48)59)45-28-14-16-31-53(45)60-54)61(41-22-7-2-8-23-41,42-24-9-3-10-25-42)43-26-11-4-12-27-43;1-4-12-29(13-5-1)33-22-25-39-36(26-33)37-28-42-38(35-18-10-11-19-41(35)50-42)27-40(37)49(39)34-23-20-32(21-24-34)45-47-43(30-14-6-2-7-15-30)46-44(48-45)31-16-8-3-9-17-31;1-3-12-28(13-4-1)30-22-23-39-35(25-30)36-27-42-37(33-18-8-10-21-41(33)48-42)26-40(36)47(39)32-17-11-16-31(24-32)44-45-38-20-9-7-19-34(38)43(46-44)29-14-5-2-6-15-29/h1-37H;1-28H;1-27H.
What are the key properties of 11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane?
11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane has a molecular weight of 2082.62 g/mol, XLogP of 35.44, 16 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-8-phenyl-[1]benzothiolo[3,2-b]carbazole;8-phenyl-11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzothiolo[3,2-b]carbazole;triphenyl-[11-[3-(4-phenylquinazolin-2-yl)phenyl]-[1]benzofuro[3,2-b]carbazol-8-yl]silane is sourced from PubChem (CID 165064672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).