11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole

C72H57N5 — CID 167268016

IUPAC11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
SMILESCC1CC(C)(C)c2cccc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8nc(-c9ccc(-c%10ccccc%10)cc9)nc(-c9ccccc9-c9ccccc9)n8)c7c65)cc4)cc3)c2C1(C)C
InChIInChI=1S/C72H57N5/c1-46-45-71(2,3)62-28-18-27-56(65(62)72(46,4)5)52-35-31-49(32-36-52)50-39-41-54(42-40-50)76-63-29-16-14-24-57(63)59-43-44-60-58-25-15-17-30-64(58)77(67(60)66(59)76)70-74-68(53-37-33-48(34-38-53)47-19-8-6-9-20-47)73-69(75-70)61-26-13-12-23-55(61)51-21-10-7-11-22-51/h6-44,46H,45H2,1-5H3
InChIKeyJJGCFOUJAHGIFH-UHFFFAOYSA-N
MW992.28 g/mol
LogP18.66
Rot. Bonds8

About 11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole

11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole (PubChem CID 167268016) has the molecular formula C72H57N5 and a molecular weight of 992.28 g/mol. Its IUPAC name is 11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole.

Molecular Properties

Compound Name11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
PubChem CID167268016
Molecular FormulaC72H57N5
Molecular Weight992.28 g/mol
Exact Mass991.46
IUPAC Name11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
SMILESCC1CC(C)(C)c2cccc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8nc(-c9ccc(-c%10ccccc%10)cc9)nc(-c9ccccc9-c9ccccc9)n8)c7c65)cc4)cc3)c2C1(C)C
InChIInChI=1S/C72H57N5/c1-46-45-71(2,3)62-28-18-27-56(65(62)72(46,4)5)52-35-31-49(32-36-52)50-39-41-54(42-40-50)76-63-29-16-14-24-57(63)59-43-44-60-58-25-15-17-30-64(58)77(67(60)66(59)76)70-74-68(53-37-33-48(34-38-53)47-19-8-6-9-20-47)73-69(75-70)61-26-13-12-23-55(61)51-21-10-7-11-22-51/h6-44,46H,45H2,1-5H3
InChIKeyJJGCFOUJAHGIFH-UHFFFAOYSA-N
XLogP18.66
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms77
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500992.28
LogP ≤ 518.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole 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

12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-[2-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]indolo[2,3-a]carbazole
CID 167268785
11-[3-[4-(5,5,6,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
CID 167268694
12-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-11-[4-(5,5,6,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)phenyl]indolo[2,3-a]carbazole
CID 167268040
12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-[4-[4-(1,1,2,2,3,3-hexamethylinden-4-yl)phenyl]phenyl]indolo[2,3-a]carbazole
CID 167268031
12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-[2-(5,5,6,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]indolo[2,3-a]carbazole
CID 167268786
7-[2-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]-5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-b]carbazole
CID 167267929
12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-[2-(5,5,6,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)phenyl]indolo[2,3-a]carbazole
CID 167268793
12-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-11-[4-(1,1,2,2,3,3-hexamethylinden-4-yl)phenyl]indolo[2,3-a]carbazole
CID 167267779
12-[4-(2-fluorophenyl)-6-phenyl-1,3,5-triazin-2-yl]-11-[2-(5,5,6,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]indolo[2,3-a]carbazole
CID 167267925
11-(3-phenylphenyl)-12-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
CID 134507200
12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]indolo[2,3-a]carbazole
CID 169036930
3-carbazol-9-yl-12-(4-phenylphenyl)-11-[4-phenyl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
CID 168729227

Frequently Asked Questions

What is the IUPAC name of 11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole?
The IUPAC name of 11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole (CID 167268016) is 11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole.
What is the SMILES notation for 11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole?
The canonical SMILES for 11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole is CC1CC(C)(C)c2cccc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8nc(-c9ccc(-c%10ccccc%10)cc9)nc(-c9ccccc9-c9ccccc9)n8)c7c65)cc4)cc3)c2C1(C)C.
What is the InChIKey of 11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole?
The InChIKey is JJGCFOUJAHGIFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H57N5/c1-46-45-71(2,3)62-28-18-27-56(65(62)72(46,4)5)52-35-31-49(32-36-52)50-39-41-54(42-40-50)76-63-29-16-14-24-57(63)59-43-44-60-58-25-15-17-30-64(58)77(67(60)66(59)76)70-74-68(53-37-33-48(34-38-53)47-19-8-6-9-20-47)73-69(75-70)61-26-13-12-23-55(61)51-21-10-7-11-22-51/h6-44,46H,45H2,1-5H3.
What are the key properties of 11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole?
11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole has a molecular weight of 992.28 g/mol, XLogP of 18.66, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[4-[4-(5,5,7,8,8-pentamethyl-6,7-dihydronaphthalen-1-yl)phenyl]phenyl]-12-[4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole is sourced from PubChem (CID 167268016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).