2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine

C90H52N6O2S2 — CID 170198628

IUPAC2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine
SMILESc1ccc(-c2cc(-c3cccc4c3oc3cc(-c5nc(-c6ccccc6)nc(-c6cccc(-c7ccc8c(c7)sc7c(-c9ccccc9)ccc(-c9cccc%10c9oc9cc(-c%11nc(-c%12ccccc%12)nc(-c%12ccccc%12)n%11)ccc9%10)c78)c6)n5)ccc34)c3c(c2)sc2ccccc23)cc1
InChIInChI=1S/C90H52N6O2S2/c1-6-21-53(22-7-1)63-48-74(80-72-33-16-17-38-77(72)99-79(80)52-63)71-37-20-35-69-66-43-41-62(50-76(66)98-83(69)71)90-95-87(57-29-14-5-15-30-57)92-88(96-90)60-32-18-31-58(47-60)59-39-44-73-78(51-59)100-84-64(54-23-8-2-9-24-54)45-46-67(81(73)84)70-36-19-34-68-65-42-40-61(49-75(65)97-82(68)70)89-93-85(55-25-10-3-11-26-55)91-86(94-89)56-27-12-4-13-28-56/h1-52H
InChIKeyWVQCHLOIWABESG-UHFFFAOYSA-N
MW1313.58 g/mol
LogP24.93
Rot. Bonds11

About 2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine

2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine (PubChem CID 170198628) has the molecular formula C90H52N6O2S2 and a molecular weight of 1313.58 g/mol. Its IUPAC name is 2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine.

Molecular Properties

Compound Name2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine
PubChem CID170198628
Molecular FormulaC90H52N6O2S2
Molecular Weight1313.58 g/mol
Exact Mass1312.36
IUPAC Name2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine
SMILESc1ccc(-c2cc(-c3cccc4c3oc3cc(-c5nc(-c6ccccc6)nc(-c6cccc(-c7ccc8c(c7)sc7c(-c9ccccc9)ccc(-c9cccc%10c9oc9cc(-c%11nc(-c%12ccccc%12)nc(-c%12ccccc%12)n%11)ccc9%10)c78)c6)n5)ccc34)c3c(c2)sc2ccccc23)cc1
InChIInChI=1S/C90H52N6O2S2/c1-6-21-53(22-7-1)63-48-74(80-72-33-16-17-38-77(72)99-79(80)52-63)71-37-20-35-69-66-43-41-62(50-76(66)98-83(69)71)90-95-87(57-29-14-5-15-30-57)92-88(96-90)60-32-18-31-58(47-60)59-39-44-73-78(51-59)100-84-64(54-23-8-2-9-24-54)45-46-67(81(73)84)70-36-19-34-68-65-42-40-61(49-75(65)97-82(68)70)89-93-85(55-25-10-3-11-26-55)91-86(94-89)56-27-12-4-13-28-56/h1-52H
InChIKeyWVQCHLOIWABESG-UHFFFAOYSA-N
XLogP24.93
TPSA103.62 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds11
Heavy Atoms100
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001313.58
LogP ≤ 524.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-phenyl-4-[6-(1-phenyldibenzothiophen-3-yl)dibenzofuran-3-yl]-6-(3-phenylphenyl)-1,3,5-triazine
CID 170200466
2,4-diphenyl-6-[7-(1-phenyldibenzothiophen-3-yl)dibenzofuran-4-yl]-1,3,5-triazine
CID 170204172
2-phenyl-4-[6-(4-phenyldibenzothiophen-1-yl)dibenzofuran-4-yl]-6-(3-phenylphenyl)-1,3,5-triazine
CID 170200294
2-phenyl-4-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-4-yl]-6-(3-phenylphenyl)-1,3,5-triazine
CID 170206847
2-[3-(9-dibenzofuran-4-yldibenzothiophen-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 155377179
2,4-diphenyl-6-[7-[1-(3-phenylphenyl)dibenzothiophen-3-yl]dibenzofuran-3-yl]-1,3,5-triazine
CID 170378738
2,4-diphenyl-6-[9-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazine
CID 170198709
2-(7-dibenzothiophen-3-yldibenzofuran-4-yl)-4-phenyl-6-(9-phenyldibenzofuran-3-yl)-1,3,5-triazine
CID 155477532
2-phenyl-4-[7-(4-phenyldibenzothiophen-2-yl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 170378458
2-phenyl-4-(9-phenyldibenzothiophen-4-yl)-6-[7-(3-phenylphenyl)dibenzofuran-4-yl]-1,3,5-triazine
CID 155096846
2,4-diphenyl-6-[6-[3-(3-phenylphenyl)dibenzothiophen-1-yl]dibenzofuran-1-yl]-1,3,5-triazine
CID 170201772
2-[3-(3-dibenzofuran-3-ylphenyl)phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[3-(3-dibenzofuran-3-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-(3-dibenzofuran-3-ylphenyl)-4-(4-phenylphenyl)-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazine;4-(4-dibenzofuran-3-ylphenyl)-6-phenyl-2-[4-(4-phenylphenyl)phenyl]pyrimidine;2-(3-dibenzothiophen-3-ylphenyl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2,4-diphenyl-6-(6-phenyldibenzofuran-3-yl)-1,3,5-triazine;2-phenyl-4,6-bis(6-phenyldibenzofuran-3-yl)-1,3,5-triazine
CID 157115619

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine?
The IUPAC name of 2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine (CID 170198628) is 2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine.
What is the SMILES notation for 2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine?
The canonical SMILES for 2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine is c1ccc(-c2cc(-c3cccc4c3oc3cc(-c5nc(-c6ccccc6)nc(-c6cccc(-c7ccc8c(c7)sc7c(-c9ccccc9)ccc(-c9cccc%10c9oc9cc(-c%11nc(-c%12ccccc%12)nc(-c%12ccccc%12)n%11)ccc9%10)c78)c6)n5)ccc34)c3c(c2)sc2ccccc23)cc1.
What is the InChIKey of 2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine?
The InChIKey is WVQCHLOIWABESG-UHFFFAOYSA-N. The full InChI is InChI=1S/C90H52N6O2S2/c1-6-21-53(22-7-1)63-48-74(80-72-33-16-17-38-77(72)99-79(80)52-63)71-37-20-35-69-66-43-41-62(50-76(66)98-83(69)71)90-95-87(57-29-14-5-15-30-57)92-88(96-90)60-32-18-31-58(47-60)59-39-44-73-78(51-59)100-84-64(54-23-8-2-9-24-54)45-46-67(81(73)84)70-36-19-34-68-65-42-40-61(49-75(65)97-82(68)70)89-93-85(55-25-10-3-11-26-55)91-86(94-89)56-27-12-4-13-28-56/h1-52H.
What are the key properties of 2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine?
2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine has a molecular weight of 1313.58 g/mol, XLogP of 24.93, 11 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-6-[6-[4-phenyl-7-[3-[4-phenyl-6-[6-(3-phenyldibenzothiophen-1-yl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]dibenzothiophen-1-yl]dibenzofuran-3-yl]-1,3,5-triazine is sourced from PubChem (CID 170198628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).