methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine

C45H33N5 — CID 158375243

IUPACmethane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine
SMILESC.c1ccc(-c2ccc(-c3cccc4c3Cc3c(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccccn7)n6)n5)cccc3-4)cc2)cc1
InChIInChI=1S/C44H29N5.CH4/c1-3-12-29(13-4-1)30-23-25-31(26-24-30)33-16-9-17-34-35-18-10-19-36(38(35)28-37(33)34)39-21-11-22-41(46-39)44-48-42(32-14-5-2-6-15-32)47-43(49-44)40-20-7-8-27-45-40;/h1-27H,28H2;1H4
InChIKeyGVCJYYLBSIWFSK-UHFFFAOYSA-N
MW643.79 g/mol
LogP10.87
Rot. Bonds6

About methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine

methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine (PubChem CID 158375243) has the molecular formula C45H33N5 and a molecular weight of 643.79 g/mol. Its IUPAC name is methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine.

Molecular Properties

Compound Namemethane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine
PubChem CID158375243
Molecular FormulaC45H33N5
Molecular Weight643.79 g/mol
Exact Mass643.27
IUPAC Namemethane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine
SMILESC.c1ccc(-c2ccc(-c3cccc4c3Cc3c(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccccn7)n6)n5)cccc3-4)cc2)cc1
InChIInChI=1S/C44H29N5.CH4/c1-3-12-29(13-4-1)30-23-25-31(26-24-30)33-16-9-17-34-35-18-10-19-36(38(35)28-37(33)34)39-21-11-22-41(46-39)44-48-42(32-14-5-2-6-15-32)47-43(49-44)40-20-7-8-27-45-40;/h1-27H,28H2;1H4
InChIKeyGVCJYYLBSIWFSK-UHFFFAOYSA-N
XLogP10.87
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500643.79
LogP ≤ 510.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine with MolForge

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Related Compounds

2,4-diphenyl-6-[3-[8-(4-phenylphenyl)-9H-fluoren-1-yl]phenyl]-1,3,5-triazine;methane
CID 162159408
2-phenyl-4,6-bis(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine
CID 59273782
2-[4-[8-[4-(4-methylphenyl)phenyl]-9H-fluoren-1-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 134509781
methane;2-phenyl-4-(4-phenylphenyl)-6-[3-[8-(3-phenylphenyl)-9H-fluoren-1-yl]phenyl]-1,3,5-triazine
CID 159922671
2,4-diphenyl-6-[3-[3-(8-phenyl-9H-fluoren-1-yl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[4-[3-(8-phenyl-9H-fluoren-1-yl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-[3-[3-(8-phenyl-9H-fluoren-1-yl)phenyl]phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-phenyl-4-[3-[3-(8-phenyl-9H-fluoren-1-yl)phenyl]phenyl]-6-(4-phenylphenyl)-1,3,5-triazine;2-phenyl-4-[4-[3-(8-phenyl-9H-fluoren-1-yl)phenyl]phenyl]-6-(3-phenylphenyl)-1,3,5-triazine;2-phenyl-4-[4-[3-(8-phenyl-9H-fluoren-1-yl)phenyl]phenyl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 158972652
2,4-diphenyl-6-[2-[4-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]phenyl]phenyl]-1,3,5-triazine
CID 164817190
2,4-dipyridin-2-yl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine
CID 144765788
2,4-diphenyl-6-[2-[4-[2-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-3-pyridinyl]phenyl]phenyl]-1,3,5-triazine
CID 164817309
2-(4-bromophenyl)-4,6-bis(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine
CID 101456405
2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 126730884
2-(4-naphthalen-2-ylphenyl)-4,6-bis(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine
CID 59273746
2,4-diphenyl-6-[2-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]phenyl]pyrimidine
CID 164817201

Frequently Asked Questions

What is the IUPAC name of methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine?
The IUPAC name of methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine (CID 158375243) is methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine.
What is the SMILES notation for methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine?
The canonical SMILES for methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine is C.c1ccc(-c2ccc(-c3cccc4c3Cc3c(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccccn7)n6)n5)cccc3-4)cc2)cc1.
What is the InChIKey of methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine?
The InChIKey is GVCJYYLBSIWFSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H29N5.CH4/c1-3-12-29(13-4-1)30-23-25-31(26-24-30)33-16-9-17-34-35-18-10-19-36(38(35)28-37(33)34)39-21-11-22-41(46-39)44-48-42(32-14-5-2-6-15-32)47-43(49-44)40-20-7-8-27-45-40;/h1-27H,28H2;1H4.
What are the key properties of methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine?
methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine has a molecular weight of 643.79 g/mol, XLogP of 10.87, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-phenyl-4-[6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-2-pyridinyl]-6-pyridin-2-yl-1,3,5-triazine is sourced from PubChem (CID 158375243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).