2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine

C157H139N13O2 — CID 163750421

About 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine

2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine (PubChem CID 163750421) has the molecular formula C157H139N13O2 and a molecular weight of 2239.93 g/mol. Its IUPAC name is 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine.

Molecular Properties

• Compound Name: 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine
• PubChem CID: 163750421
• Molecular Formula: C157H139N13O2
• Molecular Weight: 2239.93 g/mol
• Exact Mass: 2238.12
• IUPAC Name: 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine
• SMILES: CC(C)(C)c1nc(-c2ccc(-c3ccccc3)cc2)cc(-c2ccc(-c3ccccc3)cc2)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2ccc(-c3ccccc3)cc2)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2ccc3ccccc3c2)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2cccc3c2oc2ccccc23)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2cccc3ccccc23)n1.CC(C)(C)c1nc(-c2ccccc2)nc(-c2ccc3c(c2)oc2ccccc23)n1
• InChI: InChI=1S/C32H28N2.C26H22N2O.C26H24N2.C25H21N3O.2C24H22N2/c1-32(2,3)31-33-29(27-18-14-25(15-19-27)23-10-6-4-7-11-23)22-30(34-31)28-20-16-26(17-21-28)24-12-8-5-9-13-24;1-26(2,3)25-27-21(17-10-5-4-6-11-17)16-22(28-25)20-14-9-13-19-18-12-7-8-15-23(18)29-24(19)20;1-26(2,3)25-27-23(21-12-8-5-9-13-21)18-24(28-25)22-16-14-20(15-17-22)19-10-6-4-7-11-19;1-25(2,3)24-27-22(16-9-5-4-6-10-16)26-23(28-24)17-13-14-19-18-11-7-8-12-20(18)29-21(19)15-17;1-24(2,3)23-25-21(18-11-5-4-6-12-18)16-22(26-23)20-15-9-13-17-10-7-8-14-19(17)20;1-24(2,3)23-25-21(18-10-5-4-6-11-18)16-22(26-23)20-14-13-17-9-7-8-12-19(17)15-20/h4-22H,1-3H3;4-16H,1-3H3;4-18H,1-3H3;4-15H,1-3H3;2*4-16H,1-3H3
• InChIKey: LPMXTSMFEICGOX-UHFFFAOYSA-N
• XLogP: 41.15
• TPSA: 193.85 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 15
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2239.93
LogP ≤ 5	41.15
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine?

The IUPAC name of 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine (CID 163750421) is 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine.

What is the SMILES notation for 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine?

The canonical SMILES for 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine is CC(C)(C)c1nc(-c2ccc(-c3ccccc3)cc2)cc(-c2ccc(-c3ccccc3)cc2)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2ccc(-c3ccccc3)cc2)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2ccc3ccccc3c2)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2cccc3c2oc2ccccc23)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2cccc3ccccc23)n1.CC(C)(C)c1nc(-c2ccccc2)nc(-c2ccc3c(c2)oc2ccccc23)n1.

What is the InChIKey of 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine?

The InChIKey is LPMXTSMFEICGOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H28N2.C26H22N2O.C26H24N2.C25H21N3O.2C24H22N2/c1-32(2,3)31-33-29(27-18-14-25(15-19-27)23-10-6-4-7-11-23)22-30(34-31)28-20-16-26(17-21-28)24-12-8-5-9-13-24;1-26(2,3)25-27-21(17-10-5-4-6-11-17)16-22(28-25)20-14-9-13-19-18-12-7-8-15-23(18)29-24(19)20;1-26(2,3)25-27-23(21-12-8-5-9-13-21)18-24(28-25)22-16-14-20(15-17-22)19-10-6-4-7-11-19;1-25(2,3)24-27-22(16-9-5-4-6-10-16)26-23(28-24)17-13-14-19-18-11-7-8-12-20(18)29-21(19)15-17;1-24(2,3)23-25-21(18-11-5-4-6-12-18)16-22(26-23)20-15-9-13-17-10-7-8-14-19(17)20;1-24(2,3)23-25-21(18-10-5-4-6-11-18)16-22(26-23)20-14-13-17-9-7-8-12-19(17)15-20/h4-22H,1-3H3;4-16H,1-3H3;4-18H,1-3H3;4-15H,1-3H3;2*4-16H,1-3H3.

What are the key properties of 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine?

2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine has a molecular weight of 2239.93 g/mol, XLogP of 41.15, 15 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4-naphthalen-1-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine is sourced from PubChem (CID 163750421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).