4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline

C141H93N9 — CID 159815406

IUPAC4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline
SMILESc1ccc(-c2ccc(-c3cc(-c4ccc(-c5cncc6ccccc56)cc4)nc(-c4ccc(-c5ccc6ccccc6c5)cc4)n3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccc(-c5cncc6ccccc56)cc4)nc(-c4ccc(-c5ccc6ccccc6c5)cc4)n3)c2)cc1.c1cncc(-c2ccc(-c3cc(-c4cccc(-c5cccc6ccccc56)c4)nc(-c4cccc(-c5ccc6ccccc6c5)c4)n3)cc2)c1
InChIInChI=1S/3C47H31N3/c1-2-11-36-27-38(25-22-32(36)9-1)37-13-5-16-41(28-37)47-49-45(35-23-20-33(21-24-35)42-17-8-26-48-31-42)30-46(50-47)40-15-6-14-39(29-40)44-19-7-12-34-10-3-4-18-43(34)44;1-2-9-32(10-3-1)39-14-8-15-41(28-39)46-29-45(36-22-20-35(21-23-36)44-31-48-30-42-13-6-7-16-43(42)44)49-47(50-46)37-24-17-34(18-25-37)40-26-19-33-11-4-5-12-38(33)27-40;1-2-8-32(9-3-1)34-14-21-37(22-15-34)45-29-46(38-23-19-36(20-24-38)44-31-48-30-42-12-6-7-13-43(42)44)50-47(49-45)39-25-16-35(17-26-39)41-27-18-33-10-4-5-11-40(33)28-41/h3*1-31H
InChIKeyNLNZPYXRULFGNG-UHFFFAOYSA-N
MW1913.36 g/mol
LogP36.54
Rot. Bonds18

About 4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline

4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline (PubChem CID 159815406) has the molecular formula C141H93N9 and a molecular weight of 1913.36 g/mol. Its IUPAC name is 4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline.

Molecular Properties

Compound Name4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline
PubChem CID159815406
Molecular FormulaC141H93N9
Molecular Weight1913.36 g/mol
Exact Mass1911.76
IUPAC Name4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline
SMILESc1ccc(-c2ccc(-c3cc(-c4ccc(-c5cncc6ccccc56)cc4)nc(-c4ccc(-c5ccc6ccccc6c5)cc4)n3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccc(-c5cncc6ccccc56)cc4)nc(-c4ccc(-c5ccc6ccccc6c5)cc4)n3)c2)cc1.c1cncc(-c2ccc(-c3cc(-c4cccc(-c5cccc6ccccc56)c4)nc(-c4cccc(-c5ccc6ccccc6c5)c4)n3)cc2)c1
InChIInChI=1S/3C47H31N3/c1-2-11-36-27-38(25-22-32(36)9-1)37-13-5-16-41(28-37)47-49-45(35-23-20-33(21-24-35)42-17-8-26-48-31-42)30-46(50-47)40-15-6-14-39(29-40)44-19-7-12-34-10-3-4-18-43(34)44;1-2-9-32(10-3-1)39-14-8-15-41(28-39)46-29-45(36-22-20-35(21-23-36)44-31-48-30-42-13-6-7-16-43(42)44)49-47(50-46)37-24-17-34(18-25-37)40-26-19-33-11-4-5-12-38(33)27-40;1-2-8-32(9-3-1)34-14-21-37(22-15-34)45-29-46(38-23-19-36(20-24-38)44-31-48-30-42-12-6-7-13-43(42)44)50-47(49-45)39-25-16-35(17-26-39)41-27-18-33-10-4-5-11-40(33)28-41/h3*1-31H
InChIKeyNLNZPYXRULFGNG-UHFFFAOYSA-N
XLogP36.54
TPSA116.01 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds18
Heavy Atoms150
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001913.36
LogP ≤ 536.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline with MolForge

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Related Compounds

4-[4-[2-(3-naphthalen-1-ylphenyl)-6-(3-naphthalen-2-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-(3-naphthalen-2-ylphenyl)-2-(10-phenylanthracen-9-yl)-6-(3-pyridin-3-ylphenyl)pyrimidine;4-[4-[6-(3-naphthalen-2-ylphenyl)-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline
CID 159166497
2-(3-naphthalen-2-ylphenyl)-4-(4-naphthalen-1-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-(3-naphthalen-2-ylphenyl)-2-(3-phenanthren-9-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-(3-naphthalen-2-ylphenyl)-2-(3-phenylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine
CID 161484198
4-[4-[2-(3-naphthalen-2-ylphenyl)-6-(4-naphthalen-1-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline
CID 121477683
4-[4-[2-(3-naphthalen-2-ylphenyl)-6-(4-naphthalen-1-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[6-(4-naphthalen-1-ylphenyl)-2-(4-naphthalen-2-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(3-phenanthren-9-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline
CID 160657803
4-[4-[6-(3-naphthalen-2-ylphenyl)-2-(4-naphthalen-1-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[6-(3-naphthalen-2-ylphenyl)-2-(3-phenanthren-9-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(3-phenanthren-9-ylphenyl)-6-(4-phenanthren-9-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline
CID 158377697
4-[4-[2-(3-naphthalen-2-ylphenyl)-6-(4-naphthalen-2-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline
CID 121477566
4-(3-naphthalen-1-ylphenyl)-2-phenyl-6-(3-pyridin-3-ylphenyl)pyrimidine
CID 121477404
4-[4-[6-(3-naphthalen-1-ylphenyl)-2-(4-naphthalen-1-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline
CID 121384409
4-[4-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]phenyl]isoquinoline
CID 165168443
4-[4-[2-(3-naphthalen-1-ylphenyl)-6-(4-naphthalen-1-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline
CID 121384370
4-[4-[6-(3-naphthalen-2-ylphenyl)-2-(4-phenanthren-9-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(3-phenanthren-9-ylphenyl)-6-(4-phenanthren-9-ylphenyl)pyrimidin-4-yl]phenyl]isoquinoline
CID 159478984
4-(4-naphthalen-1-ylphenyl)-6-(3-pyridin-3-ylphenyl)-2-(4-triphenylen-2-ylphenyl)pyrimidine
CID 121477553

Frequently Asked Questions

What is the IUPAC name of 4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline?
The IUPAC name of 4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline (CID 159815406) is 4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline.
What is the SMILES notation for 4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline?
The canonical SMILES for 4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline is c1ccc(-c2ccc(-c3cc(-c4ccc(-c5cncc6ccccc56)cc4)nc(-c4ccc(-c5ccc6ccccc6c5)cc4)n3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccc(-c5cncc6ccccc56)cc4)nc(-c4ccc(-c5ccc6ccccc6c5)cc4)n3)c2)cc1.c1cncc(-c2ccc(-c3cc(-c4cccc(-c5cccc6ccccc56)c4)nc(-c4cccc(-c5ccc6ccccc6c5)c4)n3)cc2)c1.
What is the InChIKey of 4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline?
The InChIKey is NLNZPYXRULFGNG-UHFFFAOYSA-N. The full InChI is InChI=1S/3C47H31N3/c1-2-11-36-27-38(25-22-32(36)9-1)37-13-5-16-41(28-37)47-49-45(35-23-20-33(21-24-35)42-17-8-26-48-31-42)30-46(50-47)40-15-6-14-39(29-40)44-19-7-12-34-10-3-4-18-43(34)44;1-2-9-32(10-3-1)39-14-8-15-41(28-39)46-29-45(36-22-20-35(21-23-36)44-31-48-30-42-13-6-7-16-43(42)44)49-47(50-46)37-24-17-34(18-25-37)40-26-19-33-11-4-5-12-38(33)27-40;1-2-8-32(9-3-1)34-14-21-37(22-15-34)45-29-46(38-23-19-36(20-24-38)44-31-48-30-42-12-6-7-13-43(42)44)50-47(49-45)39-25-16-35(17-26-39)41-27-18-33-10-4-5-11-40(33)28-41/h3*1-31H.
What are the key properties of 4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline?
4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline has a molecular weight of 1913.36 g/mol, XLogP of 36.54, 18 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-naphthalen-1-ylphenyl)-2-(3-naphthalen-2-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline;4-[4-[2-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]isoquinoline is sourced from PubChem (CID 159815406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).