2-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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

C149H148N20O2S10 — CID 161318997

IUPAC2-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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
SMILESCC.CC.CC.CC.CC.CC.Cc1ccc(-c2cc(-c3cccs3)cc(-c3ccc(C)s3)c2)s1.Cc1ccc(-c2ccc(-c3cc(-c4ccc(-c5cccs5)s4)cc(-c4ccc(-c5ccc(C)s5)s4)c3)s2)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(-c2nnc(-c3ccccc3)o2)cc1.c1ccc(-c2nnc(-c3ccccc3)s2)cc1.c1cnccn1
InChIInChI=1S/C32H22S6.C24H21N3.C20H16N6.C20H16S3.C14H10N2O.C14H10N2S.C5H7N3.C4H6N2O.C4H4N2.6C2H6/c1-19-5-7-29(34-19)31-13-10-25(37-31)22-16-21(24-9-12-28(36-24)27-4-3-15-33-27)17-23(18-22)26-11-14-32(38-26)30-8-6-20(2)35-30;1-16-4-10-19(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;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;6*1-2/h3-18H,1-2H3;4-15H,1-3H3;3-12H,1-2H3;3-12H,1-2H3;2*1-10H;3H,1-2H3;1-2H3;1-4H;6*1-2H3
InChIKeyVJWSMKJTWADLKT-UHFFFAOYSA-N
MW2571.63 g/mol
LogP44.72
Rot. Bonds19

About 2-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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 161318997) has the molecular formula C149H148N20O2S10 and a molecular weight of 2571.63 g/mol. Its IUPAC name is 2-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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 Name2-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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 CID161318997
Molecular FormulaC149H148N20O2S10
Molecular Weight2571.63 g/mol
Exact Mass2568.93
IUPAC Name2-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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
SMILESCC.CC.CC.CC.CC.CC.Cc1ccc(-c2cc(-c3cccs3)cc(-c3ccc(C)s3)c2)s1.Cc1ccc(-c2ccc(-c3cc(-c4ccc(-c5cccs5)s4)cc(-c4ccc(-c5ccc(C)s5)s4)c3)s2)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(-c2nnc(-c3ccccc3)o2)cc1.c1ccc(-c2nnc(-c3ccccc3)s2)cc1.c1cnccn1
InChIInChI=1S/C32H22S6.C24H21N3.C20H16N6.C20H16S3.C14H10N2O.C14H10N2S.C5H7N3.C4H6N2O.C4H4N2.6C2H6/c1-19-5-7-29(34-19)31-13-10-25(37-31)22-16-21(24-9-12-28(36-24)27-4-3-15-33-27)17-23(18-22)26-11-14-32(38-26)30-8-6-20(2)35-30;1-16-4-10-19(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;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;6*1-2/h3-18H,1-2H3;4-15H,1-3H3;3-12H,1-2H3;3-12H,1-2H3;2*1-10H;3H,1-2H3;1-2H3;1-4H;6*1-2H3
InChIKeyVJWSMKJTWADLKT-UHFFFAOYSA-N
XLogP44.72
TPSA284.08 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds19
Heavy Atoms181
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002571.63
LogP ≤ 544.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Analyze 2-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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 161318997) is 2-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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.Cc1ccc(-c2cc(-c3cccs3)cc(-c3ccc(C)s3)c2)s1.Cc1ccc(-c2ccc(-c3cc(-c4ccc(-c5cccs5)s4)cc(-c4ccc(-c5ccc(C)s5)s4)c3)s2)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(-c2nnc(-c3ccccc3)o2)cc1.c1ccc(-c2nnc(-c3ccccc3)s2)cc1.c1cnccn1.
What is the InChIKey of 2-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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 VJWSMKJTWADLKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H22S6.C24H21N3.C20H16N6.C20H16S3.C14H10N2O.C14H10N2S.C5H7N3.C4H6N2O.C4H4N2.6C2H6/c1-19-5-7-29(34-19)31-13-10-25(37-31)22-16-21(24-9-12-28(36-24)27-4-3-15-33-27)17-23(18-22)26-11-14-32(38-26)30-8-6-20(2)35-30;1-16-4-10-19(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;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;6*1-2/h3-18H,1-2H3;4-15H,1-3H3;3-12H,1-2H3;3-12H,1-2H3;2*1-10H;3H,1-2H3;1-2H3;1-4H;6*1-2H3.
What are the key properties of 2-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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 2571.63 g/mol, XLogP of 44.72, 19 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]phenyl]-5-thiophen-2-ylthiophene;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;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 161318997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).