10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine

C194H126N18 — CID 161158065

IUPAC10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine
SMILESCc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3ccc(-c4cccc5c(-c6ccccc6)nc6ccccc6c45)cc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc5c(-c6ccccc6)nc6ccccc6c45)cc3)nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc5c(-c6ccccc6)nc6ccccc6c45)cc3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1.c1ccc(-c2nc3ccccc3c3c(-c4ccc(-c5nc(-c6ccc7ccccc7c6)nc(-c6ccc7ccccc7c6)n5)cc4)cccc23)cc1
InChIInChI=1S/2C52H33N5.C48H30N4.C42H30N4/c1-3-15-35(16-4-1)49-44-25-14-24-40(48(44)43-23-7-10-26-45(43)53-49)34-29-31-37(32-30-34)51-54-50(36-17-5-2-6-18-36)55-52(56-51)38-19-13-20-39(33-38)57-46-27-11-8-21-41(46)42-22-9-12-28-47(42)57;1-3-14-35(15-4-1)49-44-22-13-21-40(48(44)43-20-7-10-23-45(43)53-49)34-26-28-37(29-27-34)51-54-50(36-16-5-2-6-17-36)55-52(56-51)38-30-32-39(33-31-38)57-46-24-11-8-18-41(46)42-19-9-12-25-47(42)57;1-2-13-34(14-3-1)45-42-19-10-18-40(44(42)41-17-8-9-20-43(41)49-45)33-23-25-35(26-24-33)46-50-47(38-27-21-31-11-4-6-15-36(31)29-38)52-48(51-46)39-28-22-32-12-5-7-16-37(32)30-39;1-27-15-19-31(20-16-27)40-44-41(32-21-17-28(2)18-22-32)46-42(45-40)33-25-23-29(24-26-33)34-12-8-13-36-38(34)35-11-6-7-14-37(35)43-39(36)30-9-4-3-5-10-30/h2*1-33H;1-30H;3-26H,1-2H3
InChIKeyUPOCEUOYJNUPLC-UHFFFAOYSA-N
MW2709.27 g/mol
LogP48.75
Rot. Bonds22

About 10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine

10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine (PubChem CID 161158065) has the molecular formula C194H126N18 and a molecular weight of 2709.27 g/mol. Its IUPAC name is 10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine.

Molecular Properties

Compound Name10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine
PubChem CID161158065
Molecular FormulaC194H126N18
Molecular Weight2709.27 g/mol
Exact Mass2707.04
IUPAC Name10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine
SMILESCc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3ccc(-c4cccc5c(-c6ccccc6)nc6ccccc6c45)cc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc5c(-c6ccccc6)nc6ccccc6c45)cc3)nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc5c(-c6ccccc6)nc6ccccc6c45)cc3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1.c1ccc(-c2nc3ccccc3c3c(-c4ccc(-c5nc(-c6ccc7ccccc7c6)nc(-c6ccc7ccccc7c6)n5)cc4)cccc23)cc1
InChIInChI=1S/2C52H33N5.C48H30N4.C42H30N4/c1-3-15-35(16-4-1)49-44-25-14-24-40(48(44)43-23-7-10-26-45(43)53-49)34-29-31-37(32-30-34)51-54-50(36-17-5-2-6-18-36)55-52(56-51)38-19-13-20-39(33-38)57-46-27-11-8-21-41(46)42-22-9-12-28-47(42)57;1-3-14-35(15-4-1)49-44-22-13-21-40(48(44)43-20-7-10-23-45(43)53-49)34-26-28-37(29-27-34)51-54-50(36-16-5-2-6-17-36)55-52(56-51)38-30-32-39(33-31-38)57-46-24-11-8-18-41(46)42-19-9-12-25-47(42)57;1-2-13-34(14-3-1)45-42-19-10-18-40(44(42)41-17-8-9-20-43(41)49-45)33-23-25-35(26-24-33)46-50-47(38-27-21-31-11-4-6-15-36(31)29-38)52-48(51-46)39-28-22-32-12-5-7-16-37(32)30-39;1-27-15-19-31(20-16-27)40-44-41(32-21-17-28(2)18-22-32)46-42(45-40)33-25-23-29(24-26-33)34-12-8-13-36-38(34)35-11-6-7-14-37(35)43-39(36)30-9-4-3-5-10-30/h2*1-33H;1-30H;3-26H,1-2H3
InChIKeyUPOCEUOYJNUPLC-UHFFFAOYSA-N
XLogP48.75
TPSA216.10 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds22
Heavy Atoms212
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002709.27
LogP ≤ 548.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

Analyze 10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine with MolForge

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Related Compounds

10-[4-[3-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenylphenanthridine;10-[4-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenylphenanthridine;10-[4-[3-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenylphenanthridine;10-[4-[3-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylphenanthridine
CID 159416321
10-[4-[3-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-6-phenylphenanthridine
CID 146549877
2-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-6,10-diphenylphenanthridine
CID 146549083
9-[3-[4-naphthalen-2-yl-6-[4-(8-phenylnaphthalen-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole
CID 177283132
6-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-10-phenylphenanthridine
CID 146548430
6-[4-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-[1,2,5]thiadiazolo[3,4-k]phenanthridine;6-[4-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]-[1,2,5]thiadiazolo[3,4-k]phenanthridine;6-[4-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]phenyl]-[1,2,5]thiadiazolo[3,4-k]phenanthridine
CID 167638823
9-[4-[4-naphthalen-2-yl-6-[3-(8-phenylnaphthalen-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole
CID 177283094
10-[4-[2,6-bis(4-methylphenyl)pyrimidin-4-yl]phenyl]-6-phenylphenanthridine;10-[4-(2,6-dinaphthalen-2-ylpyrimidin-4-yl)phenyl]-6-phenylphenanthridine
CID 161033409
9-[3-[4-[7-(8-phenylnaphthalen-1-yl)naphthalen-2-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 177283316
20-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-10,14-diphenyl-10,15-diazapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1(13),2,4,6,8,11,14,16,18,20-decaene
CID 166584523
20-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-10,14-diphenyl-10,15-diazapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1(13),2,4,6,8,11,14,16,18,20-decaene
CID 166584758
9-[3-[2-[4-naphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]carbazole
CID 167032128

Frequently Asked Questions

What is the IUPAC name of 10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine?
The IUPAC name of 10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine (CID 161158065) is 10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine.
What is the SMILES notation for 10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine?
The canonical SMILES for 10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine is Cc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3ccc(-c4cccc5c(-c6ccccc6)nc6ccccc6c45)cc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc5c(-c6ccccc6)nc6ccccc6c45)cc3)nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-c4cccc5c(-c6ccccc6)nc6ccccc6c45)cc3)nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1.c1ccc(-c2nc3ccccc3c3c(-c4ccc(-c5nc(-c6ccc7ccccc7c6)nc(-c6ccc7ccccc7c6)n5)cc4)cccc23)cc1.
What is the InChIKey of 10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine?
The InChIKey is UPOCEUOYJNUPLC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C52H33N5.C48H30N4.C42H30N4/c1-3-15-35(16-4-1)49-44-25-14-24-40(48(44)43-23-7-10-26-45(43)53-49)34-29-31-37(32-30-34)51-54-50(36-17-5-2-6-18-36)55-52(56-51)38-19-13-20-39(33-38)57-46-27-11-8-21-41(46)42-22-9-12-28-47(42)57;1-3-14-35(15-4-1)49-44-22-13-21-40(48(44)43-20-7-10-23-45(43)53-49)34-26-28-37(29-27-34)51-54-50(36-16-5-2-6-17-36)55-52(56-51)38-30-32-39(33-31-38)57-46-24-11-8-18-41(46)42-19-9-12-25-47(42)57;1-2-13-34(14-3-1)45-42-19-10-18-40(44(42)41-17-8-9-20-43(41)49-45)33-23-25-35(26-24-33)46-50-47(38-27-21-31-11-4-6-15-36(31)29-38)52-48(51-46)39-28-22-32-12-5-7-16-37(32)30-39;1-27-15-19-31(20-16-27)40-44-41(32-21-17-28(2)18-22-32)46-42(45-40)33-25-23-29(24-26-33)34-12-8-13-36-38(34)35-11-6-7-14-37(35)43-39(36)30-9-4-3-5-10-30/h2*1-33H;1-30H;3-26H,1-2H3.
What are the key properties of 10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine?
10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine has a molecular weight of 2709.27 g/mol, XLogP of 48.75, 22 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[4-[4,6-bis(4-methylphenyl)-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-6-phenylphenanthridine;10-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]-6-phenylphenanthridine is sourced from PubChem (CID 161158065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).