bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine

C117H110N18O3S2 — CID 159539538

IUPACbis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine
SMILESCC(C)Oc1ccc(-c2ccn3c(-c4ccsc4)cnc3c2)cc1.CC(C)Oc1ccc(-c2ccn3c(-c4cncs4)cnc3c2)cc1.Cc1cc(-c2cnc3cc(-c4ccc(N5CCN(C)CC5)cc4)ccn23)c2ccccc2n1.Cc1cc(-c2cnc3cc(-c4ccc(N5CCN(C)CC5)cc4)ccn23)c2ccccc2n1.Cc1cnccc1-c1cnc2cc(-c3ccc(OC(C)C)cc3)ccn12
InChIInChI=1S/2C28H27N5.C22H21N3O.C20H18N2OS.C19H17N3OS/c2*1-20-17-25(24-5-3-4-6-26(24)30-20)27-19-29-28-18-22(11-12-33(27)28)21-7-9-23(10-8-21)32-15-13-31(2)14-16-32;1-15(2)26-19-6-4-17(5-7-19)18-9-11-25-21(14-24-22(25)12-18)20-8-10-23-13-16(20)3;1-14(2)23-18-5-3-15(4-6-18)16-7-9-22-19(12-21-20(22)11-16)17-8-10-24-13-17;1-13(2)23-16-5-3-14(4-6-16)15-7-8-22-17(10-21-19(22)9-15)18-11-20-12-24-18/h2*3-12,17-19H,13-16H2,1-2H3;4-15H,1-3H3;3-14H,1-2H3;3-13H,1-2H3
InChIKeyMEAHUGQJAWXFAN-UHFFFAOYSA-N
MW1880.42 g/mol
LogP26.14
Rot. Bonds18

About bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine

bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine (PubChem CID 159539538) has the molecular formula C117H110N18O3S2 and a molecular weight of 1880.42 g/mol. Its IUPAC name is bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Namebis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine
PubChem CID159539538
Molecular FormulaC117H110N18O3S2
Molecular Weight1880.42 g/mol
Exact Mass1878.84
IUPAC Namebis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine
SMILESCC(C)Oc1ccc(-c2ccn3c(-c4ccsc4)cnc3c2)cc1.CC(C)Oc1ccc(-c2ccn3c(-c4cncs4)cnc3c2)cc1.Cc1cc(-c2cnc3cc(-c4ccc(N5CCN(C)CC5)cc4)ccn23)c2ccccc2n1.Cc1cc(-c2cnc3cc(-c4ccc(N5CCN(C)CC5)cc4)ccn23)c2ccccc2n1.Cc1cnccc1-c1cnc2cc(-c3ccc(OC(C)C)cc3)ccn12
InChIInChI=1S/2C28H27N5.C22H21N3O.C20H18N2OS.C19H17N3OS/c2*1-20-17-25(24-5-3-4-6-26(24)30-20)27-19-29-28-18-22(11-12-33(27)28)21-7-9-23(10-8-21)32-15-13-31(2)14-16-32;1-15(2)26-19-6-4-17(5-7-19)18-9-11-25-21(14-24-22(25)12-18)20-8-10-23-13-16(20)3;1-14(2)23-18-5-3-15(4-6-18)16-7-9-22-19(12-21-20(22)11-16)17-8-10-24-13-17;1-13(2)23-16-5-3-14(4-6-16)15-7-8-22-17(10-21-19(22)9-15)18-11-20-12-24-18/h2*3-12,17-19H,13-16H2,1-2H3;4-15H,1-3H3;3-14H,1-2H3;3-13H,1-2H3
InChIKeyMEAHUGQJAWXFAN-UHFFFAOYSA-N
XLogP26.14
TPSA178.71 Ų
H-Bond Donors
H-Bond Acceptors23
Rotatable Bonds18
Heavy Atoms140
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001880.42
LogP ≤ 526.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1023

Analyze bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine with MolForge

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Related Compounds

CID 159553704
CID 159553704
N-[4-(difluoromethoxy)phenyl]-6-[6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazol-5-yl]pyrazin-2-amine;N-(4-methoxyphenyl)-6-[6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazol-5-yl]pyrazin-2-amine;N-phenyl-6-[6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazol-5-yl]pyrazin-2-amine;N-[4-(trifluoromethoxy)phenyl]-6-[6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazol-5-yl]pyrazin-2-amine;6-[2-(trifluoromethyl)imidazo[4,5-b]pyridin-1-yl]-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine
CID 161024291
Methane;4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]-7-(trifluoromethyl)quinoline;7-[4-(4-methylpiperazin-1-yl)phenyl]-3-(3-methyl-4-pyridinyl)imidazo[1,2-a]pyridine;7-[4-(4-methylpiperazin-1-yl)phenyl]-3-thiophen-3-ylimidazo[1,2-a]pyridine;7-(4-phenoxyphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine;7-(4-propan-2-yloxyphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine
CID 161510294
CID 59358444
CID 59358444
9,19-Diazapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2,4,6,8,10,12,14(18),15-nonaene;4-(2,6-dimethylphenyl)-9,19-diazapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8,10,14(18),15-octaene;12-oxa-9,19-diazapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2,4,6,8,10,14(18),15-octaene;13-oxa-9,19-diazapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(18),2,4,6,8,10,14,16-octaene;12-thia-9,19-diazapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2,4,6,8,10,14(18),15-octaene;13-thia-9,19-diazapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(18),2,4,6,8,10,14,16-octaene
CID 157096613
5-methyl-10-[4-[5-[4-(10-methylphenazin-5-yl)-3-[[9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazin-2-yl]-2-[[9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-3-id-1-yl]phenazine;10-[2-[[9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]-4-[5-[3-[[9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]-4-phenothiazin-10-ylbenzene-2-id-1-yl]pyrazin-2-yl]benzene-3-id-1-yl]phenothiazine;10-[2-[[9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]-4-[5-[3-[[9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]-4-phenoxazin-10-ylbenzene-2-id-1-yl]pyrazin-2-yl]benzene-3-id-1-yl]phenoxazine;hexakis(palladium(2+))
CID 157128160
9-[3-(4-Dibenzofuran-2-ylphenyl)phenyl]-8,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,12,14,16-octaene;9-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-8,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,12,14,16-octaene;9-(3-dibenzofuran-2-ylphenyl)-8,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,12,14,16-octaene;9-(4-dibenzofuran-2-ylphenyl)-8,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,12,14,16-octaene;9-[3-(3-dibenzothiophen-2-ylphenyl)phenyl]-8,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,12,14,16-octaene;9-[4-(3-dibenzothiophen-2-ylphenyl)phenyl]-8,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,12,14,16-octaene
CID 157176509
10-[3-Phenoxazin-10-yl-5-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine;10-[3-phenoxazin-10-yl-5-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]phenoxazine;10-[3-phenoxazin-10-yl-5-([1,3]thiazolo[4,5-c]pyridin-2-yl)phenyl]phenoxazine;10-[3-phenoxazin-10-yl-5-([1,3]thiazolo[5,4-c]pyridin-2-yl)phenyl]phenoxazine
CID 157181053
4-(3-Phenylimidazo[1,2-a]pyridin-7-yl)aniline;4-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]isoquinoline;6-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]isoquinoline;7-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]isoquinoline;3-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]quinoline
CID 157213249
N-(2-methoxyethyl)-5-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-6-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(3-methylphenyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(4-methylphenyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-phenyl-5-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine
CID 157222617
2-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-(3-methylimidazo[1,2-a]pyridin-2-yl)-1,3-thiazole;bis(4-(3-methylimidazo[1,2-a]pyridin-2-yl)-2-[2-(4-methylphenyl)ethyl]-1,3-thiazole);bis(4-(3-methylimidazo[1,2-a]pyridin-2-yl)-2-[(4-methylphenyl)methyl]-1,3-thiazole);bis(4-(3-methylimidazo[1,2-a]pyrimidin-2-yl)-2-[(4-methylphenyl)methyl]-1,3-thiazole)
CID 157283898
2-(6-amino-2-pyridinyl)-N-(2-methoxyethyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;6-cyclohexyl-N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-5-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-6-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(4-methylphenyl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-phenyl-5-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-phenyl-5-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine
CID 157296158

Frequently Asked Questions

What is the IUPAC name of bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine?
The IUPAC name of bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine (CID 159539538) is bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine?
The canonical SMILES for bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine is CC(C)Oc1ccc(-c2ccn3c(-c4ccsc4)cnc3c2)cc1.CC(C)Oc1ccc(-c2ccn3c(-c4cncs4)cnc3c2)cc1.Cc1cc(-c2cnc3cc(-c4ccc(N5CCN(C)CC5)cc4)ccn23)c2ccccc2n1.Cc1cc(-c2cnc3cc(-c4ccc(N5CCN(C)CC5)cc4)ccn23)c2ccccc2n1.Cc1cnccc1-c1cnc2cc(-c3ccc(OC(C)C)cc3)ccn12.
What is the InChIKey of bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine?
The InChIKey is MEAHUGQJAWXFAN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C28H27N5.C22H21N3O.C20H18N2OS.C19H17N3OS/c2*1-20-17-25(24-5-3-4-6-26(24)30-20)27-19-29-28-18-22(11-12-33(27)28)21-7-9-23(10-8-21)32-15-13-31(2)14-16-32;1-15(2)26-19-6-4-17(5-7-19)18-9-11-25-21(14-24-22(25)12-18)20-8-10-23-13-16(20)3;1-14(2)23-18-5-3-15(4-6-18)16-7-9-22-19(12-21-20(22)11-16)17-8-10-24-13-17;1-13(2)23-16-5-3-14(4-6-16)15-7-8-22-17(10-21-19(22)9-15)18-11-20-12-24-18/h2*3-12,17-19H,13-16H2,1-2H3;4-15H,1-3H3;3-14H,1-2H3;3-13H,1-2H3.
What are the key properties of bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine?
bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine has a molecular weight of 1880.42 g/mol, XLogP of 26.14, 18 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-methyl-4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]quinoline);3-(3-methyl-4-pyridinyl)-7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine;5-[7-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-3-yl]-1,3-thiazole;7-(4-propan-2-yloxyphenyl)-3-thiophen-3-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 159539538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).