2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine

C127H105N9 — CID 163876078

IUPAC2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2cccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c4ccccc34)c2C1(C)C.CC1(C)c2ccccc2-c2cccc(-c3cccc(-c4ccccc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2C1(C)C.CC1(C)c2ccccc2-c2cccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2C1(C)C
InChIInChI=1S/C45H37N3.C43H35N3.C39H33N3/c1-44(2)39-28-14-13-24-36(39)37-27-16-26-35(40(37)45(44,3)4)33-22-15-21-32(29-33)34-23-11-12-25-38(34)43-47-41(30-17-7-5-8-18-30)46-42(48-43)31-19-9-6-10-20-31;1-42(2)37-25-14-13-22-33(37)35-24-15-23-34(38(35)43(42,3)4)32-26-27-36(31-21-12-11-20-30(31)32)41-45-39(28-16-7-5-8-17-28)44-40(46-41)29-18-9-6-10-19-29;1-38(2)33-24-12-11-21-31(33)32-23-14-22-30(34(32)39(38,3)4)28-19-13-20-29(25-28)37-41-35(26-15-7-5-8-16-26)40-36(42-37)27-17-9-6-10-18-27/h5-29H,1-4H3;5-27H,1-4H3;5-25H,1-4H3
InChIKeyPOZBPQYTOOCCIG-UHFFFAOYSA-N
MW1757.30 g/mol
LogP32.15
Rot. Bonds13

About 2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine

2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine (PubChem CID 163876078) has the molecular formula C127H105N9 and a molecular weight of 1757.30 g/mol. Its IUPAC name is 2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine.

Molecular Properties

Compound Name2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine
PubChem CID163876078
Molecular FormulaC127H105N9
Molecular Weight1757.30 g/mol
Exact Mass1755.85
IUPAC Name2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2cccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c4ccccc34)c2C1(C)C.CC1(C)c2ccccc2-c2cccc(-c3cccc(-c4ccccc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2C1(C)C.CC1(C)c2ccccc2-c2cccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2C1(C)C
InChIInChI=1S/C45H37N3.C43H35N3.C39H33N3/c1-44(2)39-28-14-13-24-36(39)37-27-16-26-35(40(37)45(44,3)4)33-22-15-21-32(29-33)34-23-11-12-25-38(34)43-47-41(30-17-7-5-8-18-30)46-42(48-43)31-19-9-6-10-20-31;1-42(2)37-25-14-13-22-33(37)35-24-15-23-34(38(35)43(42,3)4)32-26-27-36(31-21-12-11-20-30(31)32)41-45-39(28-16-7-5-8-17-28)44-40(46-41)29-18-9-6-10-19-29;1-38(2)33-24-12-11-21-31(33)32-23-14-22-30(34(32)39(38,3)4)28-19-13-20-29(25-28)37-41-35(26-15-7-5-8-16-26)40-36(42-37)27-17-9-6-10-18-27/h5-29H,1-4H3;5-27H,1-4H3;5-25H,1-4H3
InChIKeyPOZBPQYTOOCCIG-UHFFFAOYSA-N
XLogP32.15
TPSA116.01 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds13
Heavy Atoms136
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001757.30
LogP ≤ 532.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine with MolForge

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Related Compounds

2-phenanthren-2-yl-4-phenyl-6-(9,9,10,10-tetramethylphenanthren-1-yl)-1,3,5-triazine
CID 163822142
2-dibenzofuran-3-yl-4-phenyl-6-(9,9,10,10-tetramethylphenanthren-1-yl)-1,3,5-triazine
CID 163671940
2,4-diphenyl-6-[2-[3-[9,9,10,10-tetramethyl-6-(3-phenylphenyl)phenanthren-2-yl]phenyl]phenyl]-1,3,5-triazine
CID 163623400
2-(3,5-diphenylphenyl)-4-phenyl-6-[4-(9,9'-spirobi[fluorene]-1-yl)naphthalen-1-yl]-1,3,5-triazine
CID 146649156
2-[3-(9,9-dimethylfluoren-1-yl)phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 129150867
2-dibenzofuran-1-yl-4-phenyl-6-(20,20,21,21-tetramethyl-9-oxapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1(13),2(10),3(8),4,6,11,14,16,18-nonaen-5-yl)-1,3,5-triazine
CID 163495186
2,4-dinaphthalen-1-yl-6-[3-(9,9'-spirobi[fluorene]-1'-yl)phenyl]-1,3,5-triazine
CID 167359765
2-naphthalen-1-yl-4-phenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine
CID 146648554
2,4-diphenyl-6-[2-(9,9,10,10-tetramethyl-6-phenylphenanthren-3-yl)phenyl]-1,3,5-triazine
CID 163660771
2-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-4,6-bis(2-phenylphenyl)-1,3,5-triazine
CID 118427220
2-[3-(21-pentacyclo[12.8.0.02,11.03,8.015,20]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaenyl)phenyl]-4-phenyl-6-(9,9,10,10-tetramethylphenanthren-2-yl)-1,3,5-triazine
CID 167087370
2-phenanthren-2-yl-4-phenyl-6-(9,9,10,10-tetramethylphenanthren-2-yl)-1,3,5-triazine
CID 163702512

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine?
The IUPAC name of 2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine (CID 163876078) is 2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine.
What is the SMILES notation for 2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine?
The canonical SMILES for 2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine is CC1(C)c2ccccc2-c2cccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c4ccccc34)c2C1(C)C.CC1(C)c2ccccc2-c2cccc(-c3cccc(-c4ccccc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2C1(C)C.CC1(C)c2ccccc2-c2cccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)c2C1(C)C.
What is the InChIKey of 2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine?
The InChIKey is POZBPQYTOOCCIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H37N3.C43H35N3.C39H33N3/c1-44(2)39-28-14-13-24-36(39)37-27-16-26-35(40(37)45(44,3)4)33-22-15-21-32(29-33)34-23-11-12-25-38(34)43-47-41(30-17-7-5-8-18-30)46-42(48-43)31-19-9-6-10-20-31;1-42(2)37-25-14-13-22-33(37)35-24-15-23-34(38(35)43(42,3)4)32-26-27-36(31-21-12-11-20-30(31)32)41-45-39(28-16-7-5-8-17-28)44-40(46-41)29-18-9-6-10-19-29;1-38(2)33-24-12-11-21-31(33)32-23-14-22-30(34(32)39(38,3)4)28-19-13-20-29(25-28)37-41-35(26-15-7-5-8-16-26)40-36(42-37)27-17-9-6-10-18-27/h5-29H,1-4H3;5-27H,1-4H3;5-25H,1-4H3.
What are the key properties of 2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine?
2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine has a molecular weight of 1757.30 g/mol, XLogP of 32.15, 13 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-6-[4-(9,9,10,10-tetramethylphenanthren-1-yl)naphthalen-1-yl]-1,3,5-triazine;2,4-diphenyl-6-[2-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-(9,9,10,10-tetramethylphenanthren-1-yl)phenyl]-1,3,5-triazine is sourced from PubChem (CID 163876078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).