2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine

C115H87N7O2S3 — CID 159505674

IUPAC2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine
SMILESCc1ccc(-c2cc3ccccc3cc2-c2ccccn2)cc1.Cc1nc(-c2ccsc2-c2ccccc2)c(C)n1-c1ccccc1.c1ccc(-c2coc(-c3ccccc3)c2-c2ccccn2)cc1.c1ccc(-c2csc(-c3ccccc3)c2-c2ccccn2)cc1.c1ccc(-c2occc2-c2ccccn2)cc1.c1ccc(-c2sccc2-c2ccccn2)cc1
InChIInChI=1S/C22H17N.C21H18N2S.C21H15NO.C21H15NS.C15H11NO.C15H11NS/c1-16-9-11-17(12-10-16)20-14-18-6-2-3-7-19(18)15-21(20)22-8-4-5-13-23-22;1-15-20(22-16(2)23(15)18-11-7-4-8-12-18)19-13-14-24-21(19)17-9-5-3-6-10-17;2*1-3-9-16(10-4-1)18-15-23-21(17-11-5-2-6-12-17)20(18)19-13-7-8-14-22-19;2*1-2-6-12(7-3-1)15-13(9-11-17-15)14-8-4-5-10-16-14/h2-15H,1H3;3-14H,1-2H3;2*1-15H;2*1-11H
InChIKeyLZYLNUCUTJLQDP-UHFFFAOYSA-N
MW1695.21 g/mol
LogP32.07
Rot. Bonds15

About 2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine

2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine (PubChem CID 159505674) has the molecular formula C115H87N7O2S3 and a molecular weight of 1695.21 g/mol. Its IUPAC name is 2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine.

Molecular Properties

Compound Name2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine
PubChem CID159505674
Molecular FormulaC115H87N7O2S3
Molecular Weight1695.21 g/mol
Exact Mass1693.61
IUPAC Name2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine
SMILESCc1ccc(-c2cc3ccccc3cc2-c2ccccn2)cc1.Cc1nc(-c2ccsc2-c2ccccc2)c(C)n1-c1ccccc1.c1ccc(-c2coc(-c3ccccc3)c2-c2ccccn2)cc1.c1ccc(-c2csc(-c3ccccc3)c2-c2ccccn2)cc1.c1ccc(-c2occc2-c2ccccn2)cc1.c1ccc(-c2sccc2-c2ccccn2)cc1
InChIInChI=1S/C22H17N.C21H18N2S.C21H15NO.C21H15NS.C15H11NO.C15H11NS/c1-16-9-11-17(12-10-16)20-14-18-6-2-3-7-19(18)15-21(20)22-8-4-5-13-23-22;1-15-20(22-16(2)23(15)18-11-7-4-8-12-18)19-13-14-24-21(19)17-9-5-3-6-10-17;2*1-3-9-16(10-4-1)18-15-23-21(17-11-5-2-6-12-17)20(18)19-13-7-8-14-22-19;2*1-2-6-12(7-3-1)15-13(9-11-17-15)14-8-4-5-10-16-14/h2-15H,1H3;3-14H,1-2H3;2*1-15H;2*1-11H
InChIKeyLZYLNUCUTJLQDP-UHFFFAOYSA-N
XLogP32.07
TPSA108.55 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds15
Heavy Atoms127
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001695.21
LogP ≤ 532.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine with MolForge

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Related Compounds

CID 157442309
CID 157442309
(5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-2-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[[4-[1-(6-thiophen-3-yl-2-pyridinyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[[4-[(6-thiophen-2-yl-2-pyridinyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[[4-[[6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione
CID 157512391
5,21-diazapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),2,4(9),5,7,12,17(22),18,20-nonaene;N-phenyl-1-(3-pyridin-2-ylphenyl)ethanimine;N-phenyl-1-(3-pyridin-2-ylphenyl)methanimine;N-phenyl-1-(5-pyridin-2-ylthiophen-3-yl)methanimine;9-pyridin-2-yl-5,6-dihydrobenzo[h]quinoline;2-(4-pyridin-2-ylfuran-2-yl)pyridine;2-(3-pyridin-2-ylphenyl)pyridine;2-[3-pyridin-2-yl-5-(trifluoromethyl)phenyl]pyrimidine
CID 157645742
(5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-2-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[[4-[(6-fluoronaphthalen-2-yl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[[4-[[3-(furan-2-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;bis((5Z)-5-[[2-[[4-(2-phenylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione);bis((5Z)-5-[[2-[[4-(2-pyridin-2-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione);(5Z)-5-[[2-[[4-[1-(6-thiophen-3-yl-2-pyridinyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[[4-[[6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione
CID 159592312
CID 160790822
CID 160790822
3-[6-(4,4-difluoropiperidin-1-yl)pyrimidin-4-yl]-5-(furan-3-yl)-1H-isoindole;3-[6-(4,4-difluoropiperidin-1-yl)pyrimidin-4-yl]-5-(4-methoxy-3-pyridinyl)-1H-isoindole;3-[6-(4,4-difluoropiperidin-1-yl)pyrimidin-4-yl]-5-pyridin-3-yl-1H-isoindole;3-[6-(4,4-difluoropiperidin-1-yl)pyrimidin-4-yl]-5-(1,2,3,6-tetrahydropyridin-4-yl)-1H-isoindole;3-[6-(4,4-difluoropiperidin-1-yl)pyrimidin-4-yl]-5-thiophen-3-yl-1H-isoindole;3-[6-(4-methylsulfonylpiperazin-1-yl)pyrimidin-4-yl]-5-pyridin-3-yl-1H-isoindole
CID 161136576
2-[3-(2-Fluoro-5-methylphenyl)phenyl]-4-(furan-3-yl)-6-(trifluoromethyl)pyrimidine;4-(furan-3-yl)-2-[3-(3-methylphenyl)phenyl]-6-(trifluoromethyl)pyrimidine;5-[3-[4-(furan-3-yl)-6-methylpyrimidin-2-yl]phenyl]-2-methylbenzoic acid;5-[3-[4-(furan-3-yl)pyrimidin-2-yl]phenyl]-2-methylbenzoic acid;3-[3-[4-(furan-3-yl)-6-(trifluoromethyl)pyrimidin-2-yl]phenyl]-5-methylbenzoic acid;2-methyl-5-[3-[4-(5-methylthiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]phenyl]benzoic acid;2-methyl-5-[3-[4-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-2-yl]phenyl]benzoic acid
CID 161899342
12-Dibenzothiophen-4-yl-23-thia-10-azahexacyclo[12.11.0.02,11.03,8.016,24.017,22]pentacosa-1(25),2(11),3,5,7,9,12,14,16(24),17,19,21-dodecaene;20-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-18-methyl-10-oxa-15-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;17-methyl-20-(9-phenylcarbazol-3-yl)-10-thia-15,18-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;15-methyl-20-[9-[4-(trifluoromethyl)phenyl]carbazol-3-yl]-10-thia-18-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 161901264
4-[3-[8-[3-[4,6-Bis(4-phenylpyrimidin-2-yl)-8-(2-pyridin-2-yl-3-pyridinyl)dibenzofuran-2-yl]phenyl]-4b,9b-dihydro-[1]benzothiolo[3,2-b][1]benzothiol-3-yl]phenyl]-8-[2-methyl-3-(2-methyl-3-pyrazin-2-ylphenyl)phenyl]-12-(2-pyrazin-2-yl-3-pyridinyl)-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene
CID 57958245
8-[2-Methyl-3-(2-methyl-3-pyrazin-2-ylphenyl)phenyl]-4-[3-[8-[3-[8-(2-phenyl-3-pyridinyl)-4,6-bis(4-phenylpyrimidin-2-yl)dibenzofuran-2-yl]phenyl]-4b,9b-dihydro-[1]benzothiolo[3,2-b][1]benzothiol-3-yl]phenyl]-12-(2-pyrazin-2-yl-3-pyridinyl)-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene
CID 90305841
4-[3-[8-[3-[4,6-Bis(4-phenylpyrimidin-2-yl)-8-(2-pyridin-2-yl-3-pyridinyl)dibenzofuran-2-yl]phenyl]-[1]benzothiolo[3,2-b][1]benzothiol-3-yl]phenyl]-8-[2-methyl-3-(2-methyl-3-pyrazin-2-ylphenyl)phenyl]-12-(2-pyrazin-2-yl-3-pyridinyl)-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaene
CID 118446292
N-methylidene-8-[3-[3-[3-[8-[2-methyl-3-(2-methyl-3-pyrazin-2-ylphenyl)phenyl]-12-(2-pyrazin-2-yl-3-pyridinyl)-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-4-yl]phenyl]-4b,9b-dihydro-[1]benzothiolo[3,2-b][1]benzothiol-8-yl]phenyl]-N'-[(Z)-1-phenylprop-1-enyl]-6-(4-phenylpyrimidin-2-yl)-2-(2-pyridin-2-yl-3-pyridinyl)dibenzofuran-4-carboximidamide
CID 134171674

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine?
The IUPAC name of 2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine (CID 159505674) is 2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine.
What is the SMILES notation for 2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine?
The canonical SMILES for 2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine is Cc1ccc(-c2cc3ccccc3cc2-c2ccccn2)cc1.Cc1nc(-c2ccsc2-c2ccccc2)c(C)n1-c1ccccc1.c1ccc(-c2coc(-c3ccccc3)c2-c2ccccn2)cc1.c1ccc(-c2csc(-c3ccccc3)c2-c2ccccn2)cc1.c1ccc(-c2occc2-c2ccccn2)cc1.c1ccc(-c2sccc2-c2ccccn2)cc1.
What is the InChIKey of 2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine?
The InChIKey is LZYLNUCUTJLQDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N.C21H18N2S.C21H15NO.C21H15NS.C15H11NO.C15H11NS/c1-16-9-11-17(12-10-16)20-14-18-6-2-3-7-19(18)15-21(20)22-8-4-5-13-23-22;1-15-20(22-16(2)23(15)18-11-7-4-8-12-18)19-13-14-24-21(19)17-9-5-3-6-10-17;2*1-3-9-16(10-4-1)18-15-23-21(17-11-5-2-6-12-17)20(18)19-13-7-8-14-22-19;2*1-2-6-12(7-3-1)15-13(9-11-17-15)14-8-4-5-10-16-14/h2-15H,1H3;3-14H,1-2H3;2*1-15H;2*1-11H.
What are the key properties of 2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine?
2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine has a molecular weight of 1695.21 g/mol, XLogP of 32.07, 15 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1-phenyl-4-(2-phenylthiophen-3-yl)imidazole;2-(2,4-diphenylfuran-3-yl)pyridine;2-(2,4-diphenylthiophen-3-yl)pyridine;2-[3-(4-methylphenyl)naphthalen-2-yl]pyridine;2-(2-phenylfuran-3-yl)pyridine;2-(2-phenylthiophen-3-yl)pyridine is sourced from PubChem (CID 159505674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).