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

C160H140N12O3 — CID 163417411

IUPAC2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine
SMILESCC(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(-c2ccc3c(c2)oc2ccccc23)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2ccc3ccccc3c2)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2ccc3oc4ccccc4c3c2)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2cccc3c2oc2ccccc23)n1
InChIInChI=1S/C32H28N2.3C26H22N2O.C26H24N2.C24H22N2/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)25-27-21(17-9-5-4-6-10-17)16-22(28-25)18-13-14-24-20(15-18)19-11-7-8-12-23(19)29-24;1-26(2,3)25-27-21(17-9-5-4-6-10-17)16-22(28-25)18-13-14-20-19-11-7-8-12-23(19)29-24(20)15-18;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;1-24(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;3*4-16H,1-3H3;4-18H,1-3H3;4-16H,1-3H3
InChIKeyAFPRXHXVUPTPMC-UHFFFAOYSA-N
MW2278.96 g/mol
LogP42.50
Rot. Bonds15

About 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-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-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine (PubChem CID 163417411) has the molecular formula C160H140N12O3 and a molecular weight of 2278.96 g/mol. Its IUPAC name is 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine.

Molecular Properties

Compound Name2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine
PubChem CID163417411
Molecular FormulaC160H140N12O3
Molecular Weight2278.96 g/mol
Exact Mass2277.12
IUPAC Name2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine
SMILESCC(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(-c2ccc3c(c2)oc2ccccc23)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2ccc3ccccc3c2)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2ccc3oc4ccccc4c3c2)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2cccc3c2oc2ccccc23)n1
InChIInChI=1S/C32H28N2.3C26H22N2O.C26H24N2.C24H22N2/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)25-27-21(17-9-5-4-6-10-17)16-22(28-25)18-13-14-24-20(15-18)19-11-7-8-12-23(19)29-24;1-26(2,3)25-27-21(17-9-5-4-6-10-17)16-22(28-25)18-13-14-20-19-11-7-8-12-23(19)29-24(20)15-18;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;1-24(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;3*4-16H,1-3H3;4-18H,1-3H3;4-16H,1-3H3
InChIKeyAFPRXHXVUPTPMC-UHFFFAOYSA-N
XLogP42.50
TPSA194.10 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds15
Heavy Atoms175
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002278.96
LogP ≤ 542.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine with MolForge

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Related Compounds

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
4-(3-dibenzofuran-4-ylphenyl)-2-naphthalen-2-yl-6-(4-phenylphenyl)pyrimidine
CID 130465796
4,6-bis(4-dibenzofuran-3-ylphenyl)-2-phenylpyrimidine;4,6-bis(4-dibenzofuran-4-ylphenyl)-2-phenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-6-(4-dibenzofuran-4-ylphenyl)-2-phenylpyrimidine;2,4,6-tris(4-dibenzofuran-4-ylphenyl)pyrimidine
CID 162075982
4-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-6-naphthalen-2-yl-2-phenylpyrimidine
CID 121460850
4-(4-dibenzofuran-1-ylphenyl)-2,6-diphenylpyrimidine;4-(4-dibenzofuran-2-ylphenyl)-2,6-diphenylpyrimidine;4,6-di(dibenzofuran-3-yl)-2-phenylpyrimidine;4,6-di(dibenzofuran-4-yl)-2-phenylpyrimidine;2,4,6-tri(dibenzofuran-1-yl)pyrimidine;2,4,6-tri(dibenzofuran-2-yl)pyrimidine;2,4,6-tri(dibenzofuran-3-yl)pyrimidine;2,4,6-tri(dibenzofuran-4-yl)pyrimidine
CID 159391384
4-dibenzofuran-3-yl-6-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-2-phenylpyrimidine
CID 121460851
2-dibenzofuran-3-yl-4-(3-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 130465791
2-dibenzofuran-3-yl-4-(4-dibenzofuran-4-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 130465665
4-[3,5-di(dibenzofuran-2-yl)phenyl]-2,6-diphenylpyrimidine;4-[3,5-di(dibenzofuran-4-yl)phenyl]-6-(4-naphthalen-1-ylphenyl)-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-4-yl)phenyl]-6-(4-naphthalen-2-ylphenyl)-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-2-yl)phenyl]-6-naphthalen-2-yl-2-phenylpyrimidine;4-[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine
CID 160528168
2-tert-butyl-4-dibenzofuran-4-yl-6-naphthalen-2-yl-1,3,5-triazine
CID 176646982
4-dibenzofuran-4-yl-2-methyl-6-(4-phenylphenyl)pyrimidine
CID 146717257
4-(3-dibenzofuran-4-yl-5-naphthalen-2-ylphenyl)-6-phenyl-2-(3-phenylphenyl)pyrimidine
CID 171583506

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-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-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine (CID 163417411) is 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-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-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-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-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-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(-c2ccc3c(c2)oc2ccccc23)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2ccc3ccccc3c2)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2ccc3oc4ccccc4c3c2)n1.CC(C)(C)c1nc(-c2ccccc2)cc(-c2cccc3c2oc2ccccc23)n1.
What is the InChIKey of 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-yl-6-phenylpyrimidine;2-tert-butyl-4-naphthalen-2-yl-6-phenylpyrimidine;2-tert-butyl-4-phenyl-6-(4-phenylphenyl)pyrimidine?
The InChIKey is AFPRXHXVUPTPMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H28N2.3C26H22N2O.C26H24N2.C24H22N2/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)25-27-21(17-9-5-4-6-10-17)16-22(28-25)18-13-14-24-20(15-18)19-11-7-8-12-23(19)29-24;1-26(2,3)25-27-21(17-9-5-4-6-10-17)16-22(28-25)18-13-14-20-19-11-7-8-12-23(19)29-24(20)15-18;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;1-24(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;3*4-16H,1-3H3;4-18H,1-3H3;4-16H,1-3H3.
What are the key properties of 2-tert-butyl-4,6-bis(4-phenylphenyl)pyrimidine;2-tert-butyl-4-dibenzofuran-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-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-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-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 2278.96 g/mol, XLogP of 42.50, 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-2-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-3-yl-6-phenylpyrimidine;2-tert-butyl-4-dibenzofuran-4-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 163417411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).