2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine

C35H25N3 — CID 125479874

IUPAC2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine
SMILESC[C@@]1(c2ccccc2)c2ccccc2-c2c(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cccc21
InChIInChI=1S/C35H25N3/c1-35(26-18-9-4-10-19-26)29-22-12-11-20-27(29)31-28(21-13-23-30(31)35)34-37-32(24-14-5-2-6-15-24)36-33(38-34)25-16-7-3-8-17-25/h2-23H,1H3/t35-/m1/s1
InChIKeyLVFAVSFHXZWQMK-PGUFJCEWSA-N
MW487.61 g/mol
LogP8.21
Rot. Bonds4

About 2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine

2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine (PubChem CID 125479874) has the molecular formula C35H25N3 and a molecular weight of 487.61 g/mol. Its IUPAC name is 2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine
PubChem CID125479874
Molecular FormulaC35H25N3
Molecular Weight487.61 g/mol
Exact Mass487.20
IUPAC Name2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine
SMILESC[C@@]1(c2ccccc2)c2ccccc2-c2c(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cccc21
InChIInChI=1S/C35H25N3/c1-35(26-18-9-4-10-19-26)29-22-12-11-20-27(29)31-28(21-13-23-30(31)35)34-37-32(24-14-5-2-6-15-24)36-33(38-34)25-16-7-3-8-17-25/h2-23H,1H3/t35-/m1/s1
InChIKeyLVFAVSFHXZWQMK-PGUFJCEWSA-N
XLogP8.21
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.61
LogP ≤ 58.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-[[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-(4-methylphenyl)fluoren-9-yl]phenyl]methyl]phenyl]-4-(9-methyl-9-phenylfluoren-4-yl)-6-phenyl-1,3,5-triazine
CID 123496418
2-(4-chlorophenyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine
CID 167485394
4-(7,9-dimethyl-9-phenylfluoren-4-yl)-2,6-diphenylpyrimidine
CID 154618871
4-[3-(9-methyl-4,9-diphenylfluoren-3-yl)phenyl]-2,6-diphenylpyrimidine
CID 155765228
2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-4'-yl)-4-phenyl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 153302614
4-dibenzofuran-1-yl-6-(9-methyl-9-phenylfluoren-4-yl)-2-phenylpyrimidine
CID 171602125
2-(9,9-dimethylfluoren-4-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 146632838
9-methyl-9-phenylfluoren-4-ol
CID 139484121
2,4-bis(9,9-dimethylfluoren-4-yl)-6-(4-methylphenyl)-1,3,5-triazine
CID 126543875
4-(2-dibenzofuran-4-ylphenyl)-6-(9-methyl-9-phenylfluoren-4-yl)-2-phenylpyrimidine
CID 171602778
4-[3-[3-(9-methyl-9-phenylfluoren-2-yl)phenyl]phenyl]-2,6-diphenylpyrimidine
CID 134272146
2-chloro-4-[4-(4-methyl-6-phenyl-1,3,5-triazin-2-yl)-9,9'-spirobi[fluorene]-4'-yl]-6-phenyl-1,3,5-triazine
CID 118688189

Frequently Asked Questions

What is the IUPAC name of 2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine (CID 125479874) is 2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine is C[C@@]1(c2ccccc2)c2ccccc2-c2c(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cccc21.
What is the InChIKey of 2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine?
The InChIKey is LVFAVSFHXZWQMK-PGUFJCEWSA-N. The full InChI is InChI=1S/C35H25N3/c1-35(26-18-9-4-10-19-26)29-22-12-11-20-27(29)31-28(21-13-23-30(31)35)34-37-32(24-14-5-2-6-15-24)36-33(38-34)25-16-7-3-8-17-25/h2-23H,1H3/t35-/m1/s1.
What are the key properties of 2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine?
2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine has a molecular weight of 487.61 g/mol, XLogP of 8.21, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(9R)-9-methyl-9-phenylfluoren-4-yl]-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 125479874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).