9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole

C160H101N21 — CID 163989283

IUPAC9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole
SMILESc1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)nc(-c3ccc4ccccc4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5cc6ccccc6c6ccccc56)n4)ccc3-n3c4ccccc4c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5cccc6ccccc56)n4)ccc3-n3c4ccccc4c4ccccc43)n2)cc1
InChIInChI=1S/C56H35N7.2C52H33N7/c1-4-18-36(19-5-1)51-57-52(37-20-6-2-7-21-37)61-56(60-51)47-35-40(32-33-50(47)63-48-30-16-14-28-44(48)45-29-15-17-31-49(45)63)54-58-53(38-22-8-3-9-23-38)59-55(62-54)46-34-39-24-10-11-25-41(39)42-26-12-13-27-43(42)46;1-4-18-35(19-5-1)47-53-48(36-20-6-2-7-21-36)57-52(56-47)43-33-38(31-32-46(43)59-44-29-14-12-26-40(44)41-27-13-15-30-45(41)59)50-54-49(37-22-8-3-9-23-37)55-51(58-50)42-28-16-24-34-17-10-11-25-39(34)42;1-4-17-35(18-5-1)47-54-50(39-29-28-34-16-10-11-23-38(34)32-39)56-51(55-47)40-30-31-46(59-44-26-14-12-24-41(44)42-25-13-15-27-45(42)59)43(33-40)52-57-48(36-19-6-2-7-20-36)53-49(58-52)37-21-8-3-9-22-37/h1-35H;2*1-33H
InChIKeyTZEAODOSWPRWHP-UHFFFAOYSA-N
MW2317.71 g/mol
LogP38.08
Rot. Bonds21

About 9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole

9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole (PubChem CID 163989283) has the molecular formula C160H101N21 and a molecular weight of 2317.71 g/mol. Its IUPAC name is 9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole
PubChem CID163989283
Molecular FormulaC160H101N21
Molecular Weight2317.71 g/mol
Exact Mass2315.85
IUPAC Name9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole
SMILESc1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)nc(-c3ccc4ccccc4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5cc6ccccc6c6ccccc56)n4)ccc3-n3c4ccccc4c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5cccc6ccccc56)n4)ccc3-n3c4ccccc4c4ccccc43)n2)cc1
InChIInChI=1S/C56H35N7.2C52H33N7/c1-4-18-36(19-5-1)51-57-52(37-20-6-2-7-21-37)61-56(60-51)47-35-40(32-33-50(47)63-48-30-16-14-28-44(48)45-29-15-17-31-49(45)63)54-58-53(38-22-8-3-9-23-38)59-55(62-54)46-34-39-24-10-11-25-41(39)42-26-12-13-27-43(42)46;1-4-18-35(19-5-1)47-53-48(36-20-6-2-7-21-36)57-52(56-47)43-33-38(31-32-46(43)59-44-29-14-12-26-40(44)41-27-13-15-30-45(41)59)50-54-49(37-22-8-3-9-23-37)55-51(58-50)42-28-16-24-34-17-10-11-25-39(34)42;1-4-17-35(18-5-1)47-54-50(39-29-28-34-16-10-11-23-38(34)32-39)56-51(55-47)40-30-31-46(59-44-26-14-12-24-41(44)42-25-13-15-27-45(42)59)43(33-40)52-57-48(36-19-6-2-7-20-36)53-49(58-52)37-21-8-3-9-22-37/h1-35H;2*1-33H
InChIKeyTZEAODOSWPRWHP-UHFFFAOYSA-N
XLogP38.08
TPSA246.81 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds21
Heavy Atoms181
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002317.71
LogP ≤ 538.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole?
The IUPAC name of 9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole (CID 163989283) is 9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole.
What is the SMILES notation for 9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole?
The canonical SMILES for 9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole is c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)nc(-c3ccc4ccccc4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5cc6ccccc6c6ccccc56)n4)ccc3-n3c4ccccc4c4ccccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5cccc6ccccc56)n4)ccc3-n3c4ccccc4c4ccccc43)n2)cc1.
What is the InChIKey of 9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole?
The InChIKey is TZEAODOSWPRWHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H35N7.2C52H33N7/c1-4-18-36(19-5-1)51-57-52(37-20-6-2-7-21-37)61-56(60-51)47-35-40(32-33-50(47)63-48-30-16-14-28-44(48)45-29-15-17-31-49(45)63)54-58-53(38-22-8-3-9-23-38)59-55(62-54)46-34-39-24-10-11-25-41(39)42-26-12-13-27-43(42)46;1-4-18-35(19-5-1)47-53-48(36-20-6-2-7-21-36)57-52(56-47)43-33-38(31-32-46(43)59-44-29-14-12-26-40(44)41-27-13-15-30-45(41)59)50-54-49(37-22-8-3-9-23-37)55-51(58-50)42-28-16-24-34-17-10-11-25-39(34)42;1-4-17-35(18-5-1)47-54-50(39-29-28-34-16-10-11-23-38(34)32-39)56-51(55-47)40-30-31-46(59-44-26-14-12-24-41(44)42-25-13-15-27-45(42)59)43(33-40)52-57-48(36-19-6-2-7-20-36)53-49(58-52)37-21-8-3-9-22-37/h1-35H;2*1-33H.
What are the key properties of 9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole?
9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole has a molecular weight of 2317.71 g/mol, XLogP of 38.08, 21 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole is sourced from PubChem (CID 163989283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).