5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole

C147H84N12O4S2 — CID 167610683

IUPAC5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7c8oc9ccccc9c8ccc76)ccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7c8sc9ccccc9c8ccc76)ccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7cc8c(cc76)sc6ccccc68)ccc5c34)n2)cc1
InChIInChI=1S/C49H28N4O2.2C49H28N4OS/c1-3-13-29(14-4-1)47-50-48(30-15-5-2-6-16-30)52-49(51-47)38-27-31-17-7-8-18-33(31)45-43(38)37-24-23-32(28-42(37)55-45)53-39-21-11-9-20-36(39)44-40(53)26-25-35-34-19-10-12-22-41(34)54-46(35)44;1-3-13-29(14-4-1)47-50-48(30-15-5-2-6-16-30)52-49(51-47)38-27-31-17-7-8-18-33(31)45-43(38)37-24-23-32(28-41(37)54-45)53-39-21-11-9-20-36(39)44-40(53)26-25-35-34-19-10-12-22-42(34)55-46(35)44;1-3-13-29(14-4-1)47-50-48(30-15-5-2-6-16-30)52-49(51-47)39-25-31-17-7-8-18-33(31)46-45(39)36-24-23-32(26-42(36)54-46)53-40-21-11-9-19-34(40)37-27-38-35-20-10-12-22-43(35)55-44(38)28-41(37)53/h3*1-28H
InChIKeyKZQNYEZWBQMZNU-UHFFFAOYSA-N
MW2146.50 g/mol
LogP39.70
Rot. Bonds12

About 5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole

5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole (PubChem CID 167610683) has the molecular formula C147H84N12O4S2 and a molecular weight of 2146.50 g/mol. Its IUPAC name is 5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole.

Molecular Properties

Compound Name5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole
PubChem CID167610683
Molecular FormulaC147H84N12O4S2
Molecular Weight2146.50 g/mol
Exact Mass2144.62
IUPAC Name5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7c8oc9ccccc9c8ccc76)ccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7c8sc9ccccc9c8ccc76)ccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7cc8c(cc76)sc6ccccc68)ccc5c34)n2)cc1
InChIInChI=1S/C49H28N4O2.2C49H28N4OS/c1-3-13-29(14-4-1)47-50-48(30-15-5-2-6-16-30)52-49(51-47)38-27-31-17-7-8-18-33(31)45-43(38)37-24-23-32(28-42(37)55-45)53-39-21-11-9-20-36(39)44-40(53)26-25-35-34-19-10-12-22-41(34)54-46(35)44;1-3-13-29(14-4-1)47-50-48(30-15-5-2-6-16-30)52-49(51-47)38-27-31-17-7-8-18-33(31)45-43(38)37-24-23-32(28-41(37)54-45)53-39-21-11-9-20-36(39)44-40(53)26-25-35-34-19-10-12-22-42(34)55-46(35)44;1-3-13-29(14-4-1)47-50-48(30-15-5-2-6-16-30)52-49(51-47)39-25-31-17-7-8-18-33(31)46-45(39)36-24-23-32(26-42(36)54-46)53-40-21-11-9-19-34(40)37-27-38-35-20-10-12-22-43(35)55-44(38)28-41(37)53/h3*1-28H
InChIKeyKZQNYEZWBQMZNU-UHFFFAOYSA-N
XLogP39.70
TPSA183.36 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds12
Heavy Atoms165
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002146.50
LogP ≤ 539.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole with MolForge

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Related Compounds

5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole
CID 167562279
7-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole
CID 167554675
2,7-diphenyl-9-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole;3,6-diphenyl-9-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole;12-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-[1]benzofuro[2,3-a]carbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-[1]benzofuro[3,2-c]carbazole;12-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-[1]benzothiolo[2,3-a]carbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-[1]benzothiolo[3,2-c]carbazole;2-phenyl-9-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole;3-phenyl-9-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole;9-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole;9-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole
CID 157086149
5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-[1]benzothiolo[3,2-c]carbazole
CID 147409157
5-[4-(2-carbazol-9-yl-3-phenylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole;5-[4-(2-carbazol-9-yl-3-phenylphenyl)phenyl]-[1]benzothiolo[3,2-c]carbazole;9-[4-(2-carbazol-9-yl-3-phenylphenyl)phenyl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenyl]carbazole
CID 160601837
9-dibenzothiophen-3-yl-3-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]carbazole
CID 164849997
5-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]carbazol-3-yl]-[1]benzofuro[3,2-c]carbazole;5-[9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]carbazol-3-yl]-[1]benzofuro[3,2-c]carbazole
CID 160890735
7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[2,1-b][1]benzofuran-9-yl]-[1]benzofuro[2,3-b]carbazole
CID 164707430
12-[7-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-3-yl]-[1]benzothiolo[2,3-a]carbazole;12-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-[1]benzofuro[2,3-a]carbazole;5-[7-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-[1]benzofuro[3,2-c]carbazole;5-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-[1]benzothiolo[3,2-c]carbazole
CID 159569396
5-(4-naphtho[2,1-b][1]benzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-[1]benzofuro[3,2-c]carbazole;5-(4-naphtho[2,1-b][1]benzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-[1]benzothiolo[3,2-c]carbazole;12-(4-naphtho[2,1-b][1]benzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-23-thia-12-azahexacyclo[11.11.0.02,11.03,8.016,24.017,22]tetracosa-1(13),2(11),3,5,7,9,14,16(24),17,19,21-undecaene
CID 159520742
5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-[1]benzothiolo[3,2-c]carbazole
CID 130231214
5-[4-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-3-naphtho[1,2-b][1]benzothiol-6-ylphenyl]benzo[b]carbazole
CID 155430876

Frequently Asked Questions

What is the IUPAC name of 5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole?
The IUPAC name of 5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole (CID 167610683) is 5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole.
What is the SMILES notation for 5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole?
The canonical SMILES for 5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole is c1ccc(-c2nc(-c3ccccc3)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7c8oc9ccccc9c8ccc76)ccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7c8sc9ccccc9c8ccc76)ccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7cc8c(cc76)sc6ccccc68)ccc5c34)n2)cc1.
What is the InChIKey of 5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole?
The InChIKey is KZQNYEZWBQMZNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H28N4O2.2C49H28N4OS/c1-3-13-29(14-4-1)47-50-48(30-15-5-2-6-16-30)52-49(51-47)38-27-31-17-7-8-18-33(31)45-43(38)37-24-23-32(28-42(37)55-45)53-39-21-11-9-20-36(39)44-40(53)26-25-35-34-19-10-12-22-41(34)54-46(35)44;1-3-13-29(14-4-1)47-50-48(30-15-5-2-6-16-30)52-49(51-47)38-27-31-17-7-8-18-33(31)45-43(38)37-24-23-32(28-41(37)54-45)53-39-21-11-9-20-36(39)44-40(53)26-25-35-34-19-10-12-22-42(34)55-46(35)44;1-3-13-29(14-4-1)47-50-48(30-15-5-2-6-16-30)52-49(51-47)39-25-31-17-7-8-18-33(31)46-45(39)36-24-23-32(26-42(36)54-46)53-40-21-11-9-19-34(40)37-27-38-35-20-10-12-22-43(35)55-44(38)28-41(37)53/h3*1-28H.
What are the key properties of 5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole?
5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole has a molecular weight of 2146.50 g/mol, XLogP of 39.70, 12 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzofuro[3,2-c]carbazole;7-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[2,3-b]carbazole;5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]-[1]benzothiolo[3,2-c]carbazole is sourced from PubChem (CID 167610683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).