2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine

C137H150N20O2S5 — CID 158526326

About 2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine

2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine (PubChem CID 158526326) has the molecular formula C137H150N20O2S5 and a molecular weight of 2269.18 g/mol. Its IUPAC name is 2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine.

Molecular Properties

• Compound Name: 2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine
• PubChem CID: 158526326
• Molecular Formula: C137H150N20O2S5
• Molecular Weight: 2269.18 g/mol
• Exact Mass: 2267.09
• IUPAC Name: 2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine
• SMILES: CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc(-c2cc(-c3cccs3)cc(-c3ccc(C)s3)c2)s1.Cc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3ccc(C)cc3)n2)cc1.Cc1cnc(-c2cc(-c3ncccn3)cc(-c3ncc(C)cn3)c2)nc1.Cc1ncnc(C)n1.Cc1nnc(C)o1.c1ccc(-c2ccc(-c3ccccc3)s2)cc1.c1ccc(-c2nnc(-c3ccccc3)o2)cc1.c1ccc(-c2nnc(-c3ccccc3)s2)cc1.c1cnccn1
• InChI: InChI=1S/C24H21N3.C20H16N6.C20H16S3.C16H12S.C14H10N2O.C14H10N2S.C5H7N3.C4H6N2O.C4H4N2.8C2H6/c1-16-4-10-19(11-5-16)22-25-23(20-12-6-17(2)7-13-20)27-24(26-22)21-14-8-18(3)9-15-21;1-13-9-23-19(24-10-13)16-6-15(18-21-4-3-5-22-18)7-17(8-16)20-25-11-14(2)12-26-20;1-13-5-7-19(22-13)16-10-15(18-4-3-9-21-18)11-17(12-16)20-8-6-14(2)23-20;1-3-7-13(8-4-1)15-11-12-16(17-15)14-9-5-2-6-10-14;2*1-3-7-11(8-4-1)13-15-16-14(17-13)12-9-5-2-6-10-12;1-4-6-3-7-5(2)8-4;1-3-5-6-4(2)7-3;1-2-6-4-3-5-1;8*1-2/h4-15H,1-3H3;3-12H,1-2H3;3-12H,1-2H3;1-12H;2*1-10H;3H,1-2H3;1-2H3;1-4H;8*1-2H3
• InChIKey: HMVDOYPHHATCEX-UHFFFAOYSA-N
• XLogP: 39.18
• TPSA: 284.08 Ų
• H-Bond Acceptors: 27
• Rotatable Bonds: 15
• Heavy Atoms: 164
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2269.18
LogP ≤ 5	39.18
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine?

The IUPAC name of 2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine (CID 158526326) is 2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine.

What is the SMILES notation for 2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine?

The canonical SMILES for 2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine is CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc(-c2cc(-c3cccs3)cc(-c3ccc(C)s3)c2)s1.Cc1ccc(-c2nc(-c3ccc(C)cc3)nc(-c3ccc(C)cc3)n2)cc1.Cc1cnc(-c2cc(-c3ncccn3)cc(-c3ncc(C)cn3)c2)nc1.Cc1ncnc(C)n1.Cc1nnc(C)o1.c1ccc(-c2ccc(-c3ccccc3)s2)cc1.c1ccc(-c2nnc(-c3ccccc3)o2)cc1.c1ccc(-c2nnc(-c3ccccc3)s2)cc1.c1cnccn1.

What is the InChIKey of 2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine?

The InChIKey is HMVDOYPHHATCEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3.C20H16N6.C20H16S3.C16H12S.C14H10N2O.C14H10N2S.C5H7N3.C4H6N2O.C4H4N2.8C2H6/c1-16-4-10-19(11-5-16)22-25-23(20-12-6-17(2)7-13-20)27-24(26-22)21-14-8-18(3)9-15-21;1-13-9-23-19(24-10-13)16-6-15(18-21-4-3-5-22-18)7-17(8-16)20-25-11-14(2)12-26-20;1-13-5-7-19(22-13)16-10-15(18-4-3-9-21-18)11-17(12-16)20-8-6-14(2)23-20;1-3-7-13(8-4-1)15-11-12-16(17-15)14-9-5-2-6-10-14;2*1-3-7-11(8-4-1)13-15-16-14(17-13)12-9-5-2-6-10-12;1-4-6-3-7-5(2)8-4;1-3-5-6-4(2)7-3;1-2-6-4-3-5-1;8*1-2/h4-15H,1-3H3;3-12H,1-2H3;3-12H,1-2H3;1-12H;2*1-10H;3H,1-2H3;1-2H3;1-4H;8*1-2H3.

What are the key properties of 2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine?

2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine has a molecular weight of 2269.18 g/mol, XLogP of 39.18, 15 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 2,5-dimethyl-1,3,4-oxadiazole;2,4-dimethyl-1,3,5-triazine;2,5-diphenyl-1,3,4-oxadiazole;2,5-diphenyl-1,3,4-thiadiazole;2,5-diphenylthiophene;ethane;5-methyl-2-[3-(5-methylpyrimidin-2-yl)-5-pyrimidin-2-ylphenyl]pyrimidine;2-methyl-5-[3-(5-methylthiophen-2-yl)-5-thiophen-2-ylphenyl]thiophene;pyrazine;2,4,6-tris(4-methylphenyl)-1,3,5-triazine is sourced from PubChem (CID 158526326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).