2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine

C35H27N3 — CID 169290945

IUPAC2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine
SMILESCc1cc2c(c3ccccc13)-c1ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc1C2(C)C
InChIInChI=1S/C35H27N3/c1-22-20-30-31(27-17-11-10-16-26(22)27)28-19-18-25(21-29(28)35(30,2)3)34-37-32(23-12-6-4-7-13-23)36-33(38-34)24-14-8-5-9-15-24/h4-21H,1-3H3
InChIKeyNXMAONFTTXUDLV-UHFFFAOYSA-N
MW489.62 g/mol
LogP8.64
Rot. Bonds3

About 2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine

2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine (PubChem CID 169290945) has the molecular formula C35H27N3 and a molecular weight of 489.62 g/mol. Its IUPAC name is 2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine
PubChem CID169290945
Molecular FormulaC35H27N3
Molecular Weight489.62 g/mol
Exact Mass489.22
IUPAC Name2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine
SMILESCc1cc2c(c3ccccc13)-c1ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc1C2(C)C
InChIInChI=1S/C35H27N3/c1-22-20-30-31(27-17-11-10-16-26(22)27)28-19-18-25(21-29(28)35(30,2)3)34-37-32(23-12-6-4-7-13-23)36-33(38-34)24-14-8-5-9-15-24/h4-21H,1-3H3
InChIKeyNXMAONFTTXUDLV-UHFFFAOYSA-N
XLogP8.64
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500489.62
LogP ≤ 58.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(7,7-dimethylbenzo[g]fluoren-9-yl)-4,6-diphenyl-1,3,5-triazine
CID 130355546
2-[3-(7,7-dimethylbenzo[g]fluoren-9-yl)phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 129150871
2-[3-[3-(7,7-dimethylbenzo[g]fluoren-9-yl)phenyl]phenyl]-4-[3-[9,9-dimethyl-7-[3-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]fluoren-2-yl]phenyl]-6-phenyl-1,3,5-triazine
CID 167056770
5,7,7,9-tetramethylbenzo[c]fluorene
CID 59595492
2,4-bis(9,9-dimethylfluoren-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 59188587
2-(9,9-dimethylfluoren-2-yl)-4-phenyl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 162196088
2-(9,9-dimethylfluoren-2-yl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 58233424
2,4-diphenyl-6-[4-[4-(7,9,9-trimethylfluoren-2-yl)naphthalen-1-yl]phenyl]-1,3,5-triazine
CID 157292922
2-dibenzofuran-3-yl-4-(7,7-dimethylbenzo[c]fluoren-5-yl)-6-phenyl-1,3,5-triazine
CID 155474303
2-(7,7-dimethylbenzo[c]fluoren-4-yl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 155465836
4-[4-(7,7-dimethylbenzo[c]fluoren-5-yl)naphthalen-1-yl]-2,6-diphenylpyrimidine
CID 170409613
2-(9,9-dimethylfluoren-2-yl)-4-(4-naphthalen-1-ylphenyl)-6-phenyl-1,3,5-triazine
CID 162504612

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine?
The IUPAC name of 2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine (CID 169290945) is 2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine.
What is the SMILES notation for 2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine?
The canonical SMILES for 2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine is Cc1cc2c(c3ccccc13)-c1ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc1C2(C)C.
What is the InChIKey of 2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine?
The InChIKey is NXMAONFTTXUDLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H27N3/c1-22-20-30-31(27-17-11-10-16-26(22)27)28-19-18-25(21-29(28)35(30,2)3)34-37-32(23-12-6-4-7-13-23)36-33(38-34)24-14-8-5-9-15-24/h4-21H,1-3H3.
What are the key properties of 2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine?
2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine has a molecular weight of 489.62 g/mol, XLogP of 8.64, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-6-(5,7,7-trimethylbenzo[g]fluoren-9-yl)-1,3,5-triazine is sourced from PubChem (CID 169290945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).