9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole

C150H90N12O3S2 — CID 167656369

IUPAC9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4cc5ccccc5c5oc6ccc(-n7c8ccccc8c8ccccc87)cc6c45)n3)cc21.c1ccc(-c2nc(-c3ccc4c(c3)sc3ccccc34)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7ccccc76)ccc5c34)n2)cc1.c1ccc(-c2nc(-c3cccc4sc5ccccc5c34)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7ccccc76)ccc5c34)n2)cc1
InChIInChI=1S/C52H34N4O.2C49H28N4OS/c1-52(2)42-21-11-8-18-36(42)37-26-24-33(29-43(37)52)50-53-49(31-14-4-3-5-15-31)54-51(55-50)41-28-32-16-6-7-17-35(32)48-47(41)40-30-34(25-27-46(40)57-48)56-44-22-12-9-19-38(44)39-20-10-13-23-45(39)56;1-2-13-29(14-3-1)47-50-48(37-20-12-24-43-44(37)36-19-8-11-23-42(36)55-43)52-49(51-47)38-27-30-15-4-5-16-32(30)46-45(38)35-26-25-31(28-41(35)54-46)53-39-21-9-6-17-33(39)34-18-7-10-22-40(34)53;1-2-12-29(13-3-1)47-50-48(31-22-24-37-36-18-8-11-21-43(36)55-44(37)27-31)52-49(51-47)39-26-30-14-4-5-15-33(30)46-45(39)38-25-23-32(28-42(38)54-46)53-40-19-9-6-16-34(40)35-17-7-10-20-41(35)53/h3-30H,1-2H3;2*1-28H
InChIKeyRHXCQOYKWAULNG-UHFFFAOYSA-N
MW2172.58 g/mol
LogP40.11
Rot. Bonds12

About 9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole

9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole (PubChem CID 167656369) has the molecular formula C150H90N12O3S2 and a molecular weight of 2172.58 g/mol. Its IUPAC name is 9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole.

Molecular Properties

Compound Name9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole
PubChem CID167656369
Molecular FormulaC150H90N12O3S2
Molecular Weight2172.58 g/mol
Exact Mass2170.67
IUPAC Name9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4cc5ccccc5c5oc6ccc(-n7c8ccccc8c8ccccc87)cc6c45)n3)cc21.c1ccc(-c2nc(-c3ccc4c(c3)sc3ccccc34)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7ccccc76)ccc5c34)n2)cc1.c1ccc(-c2nc(-c3cccc4sc5ccccc5c34)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7ccccc76)ccc5c34)n2)cc1
InChIInChI=1S/C52H34N4O.2C49H28N4OS/c1-52(2)42-21-11-8-18-36(42)37-26-24-33(29-43(37)52)50-53-49(31-14-4-3-5-15-31)54-51(55-50)41-28-32-16-6-7-17-35(32)48-47(41)40-30-34(25-27-46(40)57-48)56-44-22-12-9-19-38(44)39-20-10-13-23-45(39)56;1-2-13-29(14-3-1)47-50-48(37-20-12-24-43-44(37)36-19-8-11-23-42(36)55-43)52-49(51-47)38-27-30-15-4-5-16-32(30)46-45(38)35-26-25-31(28-41(35)54-46)53-39-21-9-6-17-33(39)34-18-7-10-22-40(34)53;1-2-12-29(13-3-1)47-50-48(31-22-24-37-36-18-8-11-21-43(36)55-44(37)27-31)52-49(51-47)39-26-30-14-4-5-15-33(30)46-45(39)38-25-23-32(28-42(38)54-46)53-40-19-9-6-16-34(40)35-17-7-10-20-41(35)53/h3-30H,1-2H3;2*1-28H
InChIKeyRHXCQOYKWAULNG-UHFFFAOYSA-N
XLogP40.11
TPSA170.22 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds12
Heavy Atoms167
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002172.58
LogP ≤ 540.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Analyze 9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole?
The IUPAC name of 9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole (CID 167656369) is 9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole.
What is the SMILES notation for 9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole?
The canonical SMILES for 9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole is CC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4cc5ccccc5c5oc6ccc(-n7c8ccccc8c8ccccc87)cc6c45)n3)cc21.c1ccc(-c2nc(-c3ccc4c(c3)sc3ccccc34)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7ccccc76)ccc5c34)n2)cc1.c1ccc(-c2nc(-c3cccc4sc5ccccc5c34)nc(-c3cc4ccccc4c4oc5cc(-n6c7ccccc7c7ccccc76)ccc5c34)n2)cc1.
What is the InChIKey of 9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole?
The InChIKey is RHXCQOYKWAULNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H34N4O.2C49H28N4OS/c1-52(2)42-21-11-8-18-36(42)37-26-24-33(29-43(37)52)50-53-49(31-14-4-3-5-15-31)54-51(55-50)41-28-32-16-6-7-17-35(32)48-47(41)40-30-34(25-27-46(40)57-48)56-44-22-12-9-19-38(44)39-20-10-13-23-45(39)56;1-2-13-29(14-3-1)47-50-48(37-20-12-24-43-44(37)36-19-8-11-23-42(36)55-43)52-49(51-47)38-27-30-15-4-5-16-32(30)46-45(38)35-26-25-31(28-41(35)54-46)53-39-21-9-6-17-33(39)34-18-7-10-22-40(34)53;1-2-12-29(13-3-1)47-50-48(31-22-24-37-36-18-8-11-21-43(36)55-44(37)27-31)52-49(51-47)39-26-30-14-4-5-15-33(30)46-45(39)38-25-23-32(28-42(38)54-46)53-40-19-9-6-16-34(40)35-17-7-10-20-41(35)53/h3-30H,1-2H3;2*1-28H.
What are the key properties of 9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole?
9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole has a molecular weight of 2172.58 g/mol, XLogP of 40.11, 12 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-(4-dibenzothiophen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphtho[1,2-b][1]benzofuran-9-yl]carbazole;9-[6-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-8-yl]carbazole is sourced from PubChem (CID 167656369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).