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

C141H103N9 — CID 158622998

IUPAC2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2cc(-c3nc(-c4ccccc4)nc(-c4cccc5c4Cc4c(-c6ccccc6)cccc4-5)n3)ccc21.CC1(C)c2ccccc2-c2cc(C3N=C(c4ccccc4)NC(c4cccc5c4Cc4c(-c6ccc(-c7ccccc7)cc6)cccc4-5)=N3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5cccc6c5Cc5c(-c7ccccc7)cccc5-6)n4)c3)cc21
InChIInChI=1S/C49H35N3.C49H37N3.C43H31N3/c1-49(2)44-25-10-9-20-39(44)40-27-26-34(29-45(40)49)33-18-11-19-35(28-33)47-50-46(32-16-7-4-8-17-32)51-48(52-47)41-24-13-23-38-37-22-12-21-36(42(37)30-43(38)41)31-14-5-3-6-15-31;1-49(2)44-22-10-9-17-39(44)43-29-35(27-28-45(43)49)47-50-46(34-15-7-4-8-16-34)51-48(52-47)40-21-12-20-38-37-19-11-18-36(41(37)30-42(38)40)33-25-23-32(24-26-33)31-13-5-3-6-14-31;1-43(2)38-22-10-9-17-33(38)37-25-29(23-24-39(37)43)41-44-40(28-15-7-4-8-16-28)45-42(46-41)34-21-12-20-32-31-19-11-18-30(35(31)26-36(32)34)27-13-5-3-6-14-27/h3-29H,30H2,1-2H3;3-29,47H,30H2,1-2H3,(H,50,51,52);3-25H,26H2,1-2H3
InChIKeyHYFULNDLCCKMEA-UHFFFAOYSA-N
MW1923.44 g/mol
LogP33.89
Rot. Bonds14

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

2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine (PubChem CID 158622998) has the molecular formula C141H103N9 and a molecular weight of 1923.44 g/mol. Its IUPAC name is 2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine
PubChem CID158622998
Molecular FormulaC141H103N9
Molecular Weight1923.44 g/mol
Exact Mass1921.83
IUPAC Name2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2cc(-c3nc(-c4ccccc4)nc(-c4cccc5c4Cc4c(-c6ccccc6)cccc4-5)n3)ccc21.CC1(C)c2ccccc2-c2cc(C3N=C(c4ccccc4)NC(c4cccc5c4Cc4c(-c6ccc(-c7ccccc7)cc6)cccc4-5)=N3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5cccc6c5Cc5c(-c7ccccc7)cccc5-6)n4)c3)cc21
InChIInChI=1S/C49H35N3.C49H37N3.C43H31N3/c1-49(2)44-25-10-9-20-39(44)40-27-26-34(29-45(40)49)33-18-11-19-35(28-33)47-50-46(32-16-7-4-8-17-32)51-48(52-47)41-24-13-23-38-37-22-12-21-36(42(37)30-43(38)41)31-14-5-3-6-15-31;1-49(2)44-22-10-9-17-39(44)43-29-35(27-28-45(43)49)47-50-46(34-15-7-4-8-16-34)51-48(52-47)40-21-12-20-38-37-19-11-18-36(41(37)30-42(38)40)33-25-23-32(24-26-33)31-13-5-3-6-14-31;1-43(2)38-22-10-9-17-33(38)37-25-29(23-24-39(37)43)41-44-40(28-15-7-4-8-16-28)45-42(46-41)34-21-12-20-32-31-19-11-18-30(35(31)26-36(32)34)27-13-5-3-6-14-27/h3-29H,30H2,1-2H3;3-29,47H,30H2,1-2H3,(H,50,51,52);3-25H,26H2,1-2H3
InChIKeyHYFULNDLCCKMEA-UHFFFAOYSA-N
XLogP33.89
TPSA114.09 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds14
Heavy Atoms150
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001923.44
LogP ≤ 533.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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

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Frequently Asked Questions

What is the IUPAC name of 2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine?
The IUPAC name of 2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine (CID 158622998) is 2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine.
What is the SMILES notation for 2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine?
The canonical SMILES for 2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine is CC1(C)c2ccccc2-c2cc(-c3nc(-c4ccccc4)nc(-c4cccc5c4Cc4c(-c6ccccc6)cccc4-5)n3)ccc21.CC1(C)c2ccccc2-c2cc(C3N=C(c4ccccc4)NC(c4cccc5c4Cc4c(-c6ccc(-c7ccccc7)cc6)cccc4-5)=N3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5cccc6c5Cc5c(-c7ccccc7)cccc5-6)n4)c3)cc21.
What is the InChIKey of 2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine?
The InChIKey is HYFULNDLCCKMEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H35N3.C49H37N3.C43H31N3/c1-49(2)44-25-10-9-20-39(44)40-27-26-34(29-45(40)49)33-18-11-19-35(28-33)47-50-46(32-16-7-4-8-17-32)51-48(52-47)41-24-13-23-38-37-22-12-21-36(42(37)30-43(38)41)31-14-5-3-6-15-31;1-49(2)44-22-10-9-17-39(44)43-29-35(27-28-45(43)49)47-50-46(34-15-7-4-8-16-34)51-48(52-47)40-21-12-20-38-37-19-11-18-36(41(37)30-42(38)40)33-25-23-32(24-26-33)31-13-5-3-6-14-31;1-43(2)38-22-10-9-17-33(38)37-25-29(23-24-39(37)43)41-44-40(28-15-7-4-8-16-28)45-42(46-41)34-21-12-20-32-31-19-11-18-30(35(31)26-36(32)34)27-13-5-3-6-14-27/h3-29H,30H2,1-2H3;3-29,47H,30H2,1-2H3,(H,50,51,52);3-25H,26H2,1-2H3.
What are the key properties of 2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine?
2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine has a molecular weight of 1923.44 g/mol, XLogP of 33.89, 14 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9,9-dimethylfluoren-3-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine;4-(9,9-dimethylfluoren-3-yl)-2-phenyl-6-[8-(4-phenylphenyl)-9H-fluoren-1-yl]-1,4-dihydro-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-6-(8-phenyl-9H-fluoren-1-yl)-1,3,5-triazine is sourced from PubChem (CID 158622998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).