3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline

C125H79N15 — CID 161219617

IUPAC3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
SMILESc1ccc(-c2nc(-c3ccc(-c4cnc5ccccc5c4)cc3)nc(-c3ccc(-c4cnc5ccccc5c4)cc3)n2)cc1.c1ccc2cc(-c3nc(-c4ccc(-c5cnc6ccccc6c5)cc4)nc(-c4ccc(-c5cnc6ccccc6c5)cc4)n3)ccc2c1.c1ccc2ncc(-c3ccc(-c4nc(-c5ccc(-c6cnc7ccccc7c6)cc5)nc(-c5cccc6ccccc56)n4)cc3)cc2c1
InChIInChI=1S/2C43H27N5.C39H25N5/c1-4-12-37-30(8-1)11-7-13-38(37)43-47-41(31-20-16-28(17-21-31)35-24-33-9-2-5-14-39(33)44-26-35)46-42(48-43)32-22-18-29(19-23-32)36-25-34-10-3-6-15-40(34)45-27-36;1-2-8-33-23-36(22-17-28(33)7-1)43-47-41(31-18-13-29(14-19-31)37-24-34-9-3-5-11-39(34)44-26-37)46-42(48-43)32-20-15-30(16-21-32)38-25-35-10-4-6-12-40(35)45-27-38;1-2-8-28(9-3-1)37-42-38(29-18-14-26(15-19-29)33-22-31-10-4-6-12-35(31)40-24-33)44-39(43-37)30-20-16-27(17-21-30)34-23-32-11-5-7-13-36(32)41-25-34/h2*1-27H;1-25H
InChIKeyUXIJIQWBBWSOGV-UHFFFAOYSA-N
MW1791.11 g/mol
LogP30.22
Rot. Bonds15

About 3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline

3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline (PubChem CID 161219617) has the molecular formula C125H79N15 and a molecular weight of 1791.11 g/mol. Its IUPAC name is 3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline.

Molecular Properties

Compound Name3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
PubChem CID161219617
Molecular FormulaC125H79N15
Molecular Weight1791.11 g/mol
Exact Mass1789.66
IUPAC Name3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
SMILESc1ccc(-c2nc(-c3ccc(-c4cnc5ccccc5c4)cc3)nc(-c3ccc(-c4cnc5ccccc5c4)cc3)n2)cc1.c1ccc2cc(-c3nc(-c4ccc(-c5cnc6ccccc6c5)cc4)nc(-c4ccc(-c5cnc6ccccc6c5)cc4)n3)ccc2c1.c1ccc2ncc(-c3ccc(-c4nc(-c5ccc(-c6cnc7ccccc7c6)cc5)nc(-c5cccc6ccccc56)n4)cc3)cc2c1
InChIInChI=1S/2C43H27N5.C39H25N5/c1-4-12-37-30(8-1)11-7-13-38(37)43-47-41(31-20-16-28(17-21-31)35-24-33-9-2-5-14-39(33)44-26-35)46-42(48-43)32-22-18-29(19-23-32)36-25-34-10-3-6-15-40(34)45-27-36;1-2-8-33-23-36(22-17-28(33)7-1)43-47-41(31-18-13-29(14-19-31)37-24-34-9-3-5-11-39(34)44-26-37)46-42(48-43)32-20-15-30(16-21-32)38-25-35-10-4-6-12-40(35)45-27-38;1-2-8-28(9-3-1)37-42-38(29-18-14-26(15-19-29)33-22-31-10-4-6-12-35(31)40-24-33)44-39(43-37)30-20-16-27(17-21-30)34-23-32-11-5-7-13-36(32)41-25-34/h2*1-27H;1-25H
InChIKeyUXIJIQWBBWSOGV-UHFFFAOYSA-N
XLogP30.22
TPSA193.35 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds15
Heavy Atoms140
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001791.11
LogP ≤ 530.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline?
The IUPAC name of 3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline (CID 161219617) is 3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline.
What is the SMILES notation for 3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline?
The canonical SMILES for 3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline is c1ccc(-c2nc(-c3ccc(-c4cnc5ccccc5c4)cc3)nc(-c3ccc(-c4cnc5ccccc5c4)cc3)n2)cc1.c1ccc2cc(-c3nc(-c4ccc(-c5cnc6ccccc6c5)cc4)nc(-c4ccc(-c5cnc6ccccc6c5)cc4)n3)ccc2c1.c1ccc2ncc(-c3ccc(-c4nc(-c5ccc(-c6cnc7ccccc7c6)cc5)nc(-c5cccc6ccccc56)n4)cc3)cc2c1.
What is the InChIKey of 3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline?
The InChIKey is UXIJIQWBBWSOGV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C43H27N5.C39H25N5/c1-4-12-37-30(8-1)11-7-13-38(37)43-47-41(31-20-16-28(17-21-31)35-24-33-9-2-5-14-39(33)44-26-35)46-42(48-43)32-22-18-29(19-23-32)36-25-34-10-3-6-15-40(34)45-27-36;1-2-8-33-23-36(22-17-28(33)7-1)43-47-41(31-18-13-29(14-19-31)37-24-34-9-3-5-11-39(34)44-26-37)46-42(48-43)32-20-15-30(16-21-32)38-25-35-10-4-6-12-40(35)45-27-38;1-2-8-28(9-3-1)37-42-38(29-18-14-26(15-19-29)33-22-31-10-4-6-12-35(31)40-24-33)44-39(43-37)30-20-16-27(17-21-30)34-23-32-11-5-7-13-36(32)41-25-34/h2*1-27H;1-25H.
What are the key properties of 3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline?
3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline has a molecular weight of 1791.11 g/mol, XLogP of 30.22, 15 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-[4-naphthalen-1-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenyl-6-(4-quinolin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline is sourced from PubChem (CID 161219617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).