1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole

C412H258N24O2S2 — CID 160930419

IUPAC1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole
SMILESC1=CC2N=C(c3ccc(-c4cc5ccc6cc(-c7ccc8ccccc8c7)cc7ccc(c4)c5c67)cc3)N(c3ccccc3)C2C=C1.C1=CC2N=C(c3ccc(-c4cc5ccc6cccc7ccc(c4)c5c67)cc3)N(c3ccccc3)C2C=C1.c1cc2ccc3cc(-c4ccc(-c5nc6ccccc6o5)cc4)cc4ccc(c1)c2c34.c1cc2ccc3cc(-c4ccc(-c5nc6ccccc6s5)cc4)cc4ccc(c1)c2c34.c1cc2ccc3cc(-c4ccc(-n5ccnc5)cc4)cc4ccc(c1)c2c34.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3cc4ccc5cc(-c6c7ccccc7cc7ccccc67)cc6ccc(c3)c4c56)cc2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3cc4ccc5cccc6ccc(c3)c4c56)cc2)cc1.c1ccc(-c2nc3ccccn3c2-c2ccc(-c3cc4ccc5cccc6ccc(c3)c4c56)cc2)cc1.c1ccc(-c2nc3ncccn3c2-c2ccc(-c3cc4ccc5cccc6ccc(c3)c4c56)cc2)cc1.c1ccc(-c2nnc(-c3ccc(-c4cc5ccc6cccc7ccc(c4)c5c67)cc3)n2-c2ccccc2)cc1.c1ccc(-c2nnc(-c3ccc(-c4cc5ccc6cccc7ccc(c4)c5c67)cc3)o2)cc1.c1ccc(-c2nnc(-c3ccc(-c4cc5ccc6cccc7ccc(c4)c5c67)cc3)s2)cc1
InChIInChI=1S/C49H30N2.C45H30N2.C36H23N3.C35H24N2.2C35H22N2.C34H21N3.C30H18N2O.C30H18N2S.C29H17NO.C29H17NS.C25H16N2/c1-2-10-32(11-3-1)49-50-44-16-8-9-17-45(44)51(49)41-24-22-31(23-25-41)39-27-35-18-20-37-29-40(30-38-21-19-36(28-39)46(35)47(37)38)48-42-14-6-4-12-33(42)26-34-13-5-7-15-43(34)48;1-2-10-40(11-3-1)47-42-13-7-6-12-41(42)46-45(47)31-17-14-30(15-18-31)38-25-34-20-22-36-27-39(28-37-23-21-35(26-38)43(34)44(36)37)33-19-16-29-8-4-5-9-32(29)24-33;1-3-8-27(9-4-1)35-37-38-36(39(35)32-12-5-2-6-13-32)28-18-14-24(15-19-28)31-22-29-20-16-25-10-7-11-26-17-21-30(23-31)34(29)33(25)26;1-2-9-30(10-3-1)37-32-12-5-4-11-31(32)36-35(37)26-17-13-23(14-18-26)29-21-27-19-15-24-7-6-8-25-16-20-28(22-29)34(27)33(24)25;1-2-7-26(8-3-1)34-35(37-20-5-4-11-31(37)36-34)27-16-12-23(13-17-27)30-21-28-18-14-24-9-6-10-25-15-19-29(22-30)33(28)32(24)25;1-2-7-26(8-3-1)35-36-31-11-4-5-12-32(31)37(35)30-19-17-23(18-20-30)29-21-27-15-13-24-9-6-10-25-14-16-28(22-29)34(27)33(24)25;1-2-6-25(7-3-1)32-33(37-19-5-18-35-34(37)36-32)26-14-10-22(11-15-26)29-20-27-16-12-23-8-4-9-24-13-17-28(21-29)31(27)30(23)24;2*1-2-5-22(6-3-1)29-31-32-30(33-29)23-13-9-19(10-14-23)26-17-24-15-11-20-7-4-8-21-12-16-25(18-26)28(24)27(20)21;2*1-2-7-26-25(6-1)30-29(31-26)21-12-8-18(9-13-21)24-16-22-14-10-19-4-3-5-20-11-15-23(17-24)28(22)27(19)20;1-2-18-4-6-20-14-22(15-21-7-5-19(3-1)24(18)25(20)21)17-8-10-23(11-9-17)27-13-12-26-16-27/h1-30H;1-28,41-42H;1-23H;1-22,31-32H;2*1-22H;1-21H;2*1-18H;2*1-17H;1-16H
InChIKeySTEOJGKKNJDMHJ-UHFFFAOYSA-N
MW5640.90 g/mol
LogP108.52
Rot. Bonds36

About 1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole

1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole (PubChem CID 160930419) has the molecular formula C412H258N24O2S2 and a molecular weight of 5640.90 g/mol. Its IUPAC name is 1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole.

Molecular Properties

Compound Name1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole
PubChem CID160930419
Molecular FormulaC412H258N24O2S2
Molecular Weight5640.90 g/mol
Exact Mass5636.03
IUPAC Name1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole
SMILESC1=CC2N=C(c3ccc(-c4cc5ccc6cc(-c7ccc8ccccc8c7)cc7ccc(c4)c5c67)cc3)N(c3ccccc3)C2C=C1.C1=CC2N=C(c3ccc(-c4cc5ccc6cccc7ccc(c4)c5c67)cc3)N(c3ccccc3)C2C=C1.c1cc2ccc3cc(-c4ccc(-c5nc6ccccc6o5)cc4)cc4ccc(c1)c2c34.c1cc2ccc3cc(-c4ccc(-c5nc6ccccc6s5)cc4)cc4ccc(c1)c2c34.c1cc2ccc3cc(-c4ccc(-n5ccnc5)cc4)cc4ccc(c1)c2c34.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3cc4ccc5cc(-c6c7ccccc7cc7ccccc67)cc6ccc(c3)c4c56)cc2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3cc4ccc5cccc6ccc(c3)c4c56)cc2)cc1.c1ccc(-c2nc3ccccn3c2-c2ccc(-c3cc4ccc5cccc6ccc(c3)c4c56)cc2)cc1.c1ccc(-c2nc3ncccn3c2-c2ccc(-c3cc4ccc5cccc6ccc(c3)c4c56)cc2)cc1.c1ccc(-c2nnc(-c3ccc(-c4cc5ccc6cccc7ccc(c4)c5c67)cc3)n2-c2ccccc2)cc1.c1ccc(-c2nnc(-c3ccc(-c4cc5ccc6cccc7ccc(c4)c5c67)cc3)o2)cc1.c1ccc(-c2nnc(-c3ccc(-c4cc5ccc6cccc7ccc(c4)c5c67)cc3)s2)cc1
InChIInChI=1S/C49H30N2.C45H30N2.C36H23N3.C35H24N2.2C35H22N2.C34H21N3.C30H18N2O.C30H18N2S.C29H17NO.C29H17NS.C25H16N2/c1-2-10-32(11-3-1)49-50-44-16-8-9-17-45(44)51(49)41-24-22-31(23-25-41)39-27-35-18-20-37-29-40(30-38-21-19-36(28-39)46(35)47(37)38)48-42-14-6-4-12-33(42)26-34-13-5-7-15-43(34)48;1-2-10-40(11-3-1)47-42-13-7-6-12-41(42)46-45(47)31-17-14-30(15-18-31)38-25-34-20-22-36-27-39(28-37-23-21-35(26-38)43(34)44(36)37)33-19-16-29-8-4-5-9-32(29)24-33;1-3-8-27(9-4-1)35-37-38-36(39(35)32-12-5-2-6-13-32)28-18-14-24(15-19-28)31-22-29-20-16-25-10-7-11-26-17-21-30(23-31)34(29)33(25)26;1-2-9-30(10-3-1)37-32-12-5-4-11-31(32)36-35(37)26-17-13-23(14-18-26)29-21-27-19-15-24-7-6-8-25-16-20-28(22-29)34(27)33(24)25;1-2-7-26(8-3-1)34-35(37-20-5-4-11-31(37)36-34)27-16-12-23(13-17-27)30-21-28-18-14-24-9-6-10-25-15-19-29(22-30)33(28)32(24)25;1-2-7-26(8-3-1)35-36-31-11-4-5-12-32(31)37(35)30-19-17-23(18-20-30)29-21-27-15-13-24-9-6-10-25-14-16-28(22-29)34(27)33(24)25;1-2-6-25(7-3-1)32-33(37-19-5-18-35-34(37)36-32)26-14-10-22(11-15-26)29-20-27-16-12-23-8-4-9-24-13-17-28(21-29)31(27)30(23)24;2*1-2-5-22(6-3-1)29-31-32-30(33-29)23-13-9-19(10-14-23)26-17-24-15-11-20-7-4-8-21-12-16-25(18-26)28(24)27(20)21;2*1-2-7-26-25(6-1)30-29(31-26)21-12-8-18(9-13-21)24-16-22-14-10-19-4-3-5-20-11-15-23(17-24)28(22)27(19)20;1-2-18-4-6-20-14-22(15-21-7-5-19(3-1)24(18)25(20)21)17-8-10-23(11-9-17)27-13-12-26-16-27/h1-30H;1-28,41-42H;1-23H;1-22,31-32H;2*1-22H;1-21H;2*1-18H;2*1-17H;1-16H
InChIKeySTEOJGKKNJDMHJ-UHFFFAOYSA-N
XLogP108.52
TPSA266.48 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds36
Heavy Atoms440
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005640.90
LogP ≤ 5108.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Analyze 1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole with MolForge

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Related Compounds

1-cyclohexyl-3-propan-2-ylbenzene;1-cyclopentyl-3-propan-2-ylbenzene;2-methyl-4-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylimidazo[1,2-a]pyridine;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;1-(2-propan-2-ylphenyl)pyrrolidine;2-propan-2-ylquinazoline;3-propan-2-ylquinoline;4-propan-2-ylquinoline;2-propan-2-ylquinoxaline;2-propan-2-yl-3-(trifluoromethyl)pyridine
CID 157464689
dialuminum;diberyllium;tetragallium;[2-(1,3-benzothiazol-2-yl)phenyl]-methylsulfonylazanide;bis(N-[2-(benzotriazol-2-yl)phenyl]-2,2,2-trifluoroethanimidate);[2-(1,3-benzoxazol-2-yl)phenyl]-pyrazin-2-ylazanide;2-(1-methylpyrrol-2-yl)phenolate;bis([2-(1-phenylbenzimidazol-2-yl)phenyl]-(trifluoromethyl)azanide);2-pyridin-2-ylnaphthalen-1-olate
CID 157512452
Dialuminum;trigallium;[2-(1,3-benzothiazol-2-yl)phenyl]-methylsulfonylazanide;[2-(1,3-benzoxazol-2-yl)phenyl]-pyrazin-2-ylazanide;7-(3-methylphenyl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-olate;7-(4-methylphenyl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-olate;2-pyridin-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a][1,3,5]triazin-4-olate
CID 157760113
2-[3-(10b,10c-Dihydropyren-4-yl)-5-pyridin-3-ylphenyl]-1,3-benzothiazole;2-[3-(10b,10c-dihydropyren-4-yl)-5-pyridin-3-ylphenyl]-1,3-benzothiazole-6-carbonitrile;5-[6-(1-phenylbenzimidazol-2-yl)-2-pyridin-3-ylpyrimidin-4-yl]-1,10-phenanthroline;2-(4-pyridin-3-yl-6-pyrimidin-2-yl-1,3,5-triazin-2-yl)-6-(trifluoromethyl)-1,3-benzoxazole
CID 157769145
2-[3-(10b,10c-Dihydropyren-4-yl)-5-[4-(3,5-diphenyl-1,2,4-triazol-4-yl)phenyl]phenyl]-1,3-benzoxazole;2-[3-benzo[h]quinolin-5-yl-5-[3-[5-(3,5-dimethylphenyl)-4-phenyl-1,2,4-triazol-3-yl]phenyl]phenyl]-1,3-benzothiazole;2-[3-[4-[3-(4-methylphenyl)-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-4-yl]phenyl]-5-quinolin-5-ylphenyl]-1,3-benzoxazole
CID 157966551
CID 158633368
CID 158633368
CID 158717243
CID 158717243
dialuminum;diberyllium;tetrazinc;bis([2-(1,3-benzothiazol-2-yl)phenyl]-methylsulfonylazanide);bis(N-[2-(benzotriazol-2-yl)phenyl]-2,2,2-trifluoroethanimidate);bis([2-(1,3-benzoxazol-2-yl)phenyl]-pyrazin-2-ylazanide);bis([2-(1-phenylbenzimidazol-2-yl)phenyl]-(trifluoromethyl)azanide)
CID 159069487
2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylimidazo[1,2-a]pyridine;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-ylnaphthalene;2-propan-2-ylquinazoline;3-propan-2-ylquinoline;4-propan-2-ylquinoline;2-propan-2-ylquinoxaline;2-propan-2-yl-[1,3]thiazolo[4,5-b]pyridine;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine;2-propan-2-yl-[1,3]thiazolo[5,4-c]pyridine;2-propan-2-yl-4-(trifluoromethyl)pyridine;2-propan-2-yl-6-(trifluoromethyl)pyridine;3-propan-2-yl-5-(trifluoromethyl)pyridine;4-propan-2-yl-2-(trifluoromethyl)pyridine
CID 159430087
2,3-dimethyl-1,3-benzothiazol-3-ium;2,3-dimethyl-2H-1,3-benzoxazole;2,3-dimethyl-1,3-oxazol-3-ium;1,2-dimethylpyrimidin-1-ium;1,2-dimethyl-5-(trifluoromethyl)pyridin-1-ium;3-methyldithiol-1-ium;2-methyl-1,3-oxazole;2-methylpyrylium;2-methylthiopyrylium;1,2,3-trimethylbenzimidazol-3-ium;1,2,3-trimethyl-2H-imidazole-1,3-diium;1,2,3-trimethylpyrazol-1-ium;1,4,5-trimethyl-1,2,4-triazol-4-ium
CID 160116091
2-[3-(10b,10c-Dihydropyren-4-yl)-5-pyridin-3-ylphenyl]-1,3-benzothiazole;5-[6-(1-phenylbenzimidazol-2-yl)-2-pyridin-3-ylpyrimidin-4-yl]-1,10-phenanthroline;2-(4-pyridin-3-yl-6-pyrimidin-2-yl-1,3,5-triazin-2-yl)-1,3-benzoxazole;2-(4-pyridin-3-yl-6-pyrimidin-2-yl-1,3,5-triazin-2-yl)-6-(trifluoromethyl)-1,3-benzoxazole
CID 160449291
2-(1-Benzothiophen-2-yl)pyridine;2-(9,9-diethylfluoren-2-yl)-1-phenylbenzimidazole;4,7-diphenylbenzo[h]quinoline;9-ethyl-2-(1-phenylbenzimidazol-2-yl)carbazole;2-(5-methylthiophen-2-yl)pyridine;2-naphthalen-1-yl-1,3-benzoxazole;2-phenyl-1,3-benzothiazole;2-phenylpyridine;2-quinolin-2-ylquinoline;2-thiophen-2-yl-5-(trifluoromethyl)pyridine
CID 160455830

Frequently Asked Questions

What is the IUPAC name of 1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole?
The IUPAC name of 1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole (CID 160930419) is 1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole.
What is the SMILES notation for 1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole?
The canonical SMILES for 1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole is C1=CC2N=C(c3ccc(-c4cc5ccc6cc(-c7ccc8ccccc8c7)cc7ccc(c4)c5c67)cc3)N(c3ccccc3)C2C=C1.C1=CC2N=C(c3ccc(-c4cc5ccc6cccc7ccc(c4)c5c67)cc3)N(c3ccccc3)C2C=C1.c1cc2ccc3cc(-c4ccc(-c5nc6ccccc6o5)cc4)cc4ccc(c1)c2c34.c1cc2ccc3cc(-c4ccc(-c5nc6ccccc6s5)cc4)cc4ccc(c1)c2c34.c1cc2ccc3cc(-c4ccc(-n5ccnc5)cc4)cc4ccc(c1)c2c34.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3cc4ccc5cc(-c6c7ccccc7cc7ccccc67)cc6ccc(c3)c4c56)cc2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3cc4ccc5cccc6ccc(c3)c4c56)cc2)cc1.c1ccc(-c2nc3ccccn3c2-c2ccc(-c3cc4ccc5cccc6ccc(c3)c4c56)cc2)cc1.c1ccc(-c2nc3ncccn3c2-c2ccc(-c3cc4ccc5cccc6ccc(c3)c4c56)cc2)cc1.c1ccc(-c2nnc(-c3ccc(-c4cc5ccc6cccc7ccc(c4)c5c67)cc3)n2-c2ccccc2)cc1.c1ccc(-c2nnc(-c3ccc(-c4cc5ccc6cccc7ccc(c4)c5c67)cc3)o2)cc1.c1ccc(-c2nnc(-c3ccc(-c4cc5ccc6cccc7ccc(c4)c5c67)cc3)s2)cc1.
What is the InChIKey of 1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole?
The InChIKey is STEOJGKKNJDMHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H30N2.C45H30N2.C36H23N3.C35H24N2.2C35H22N2.C34H21N3.C30H18N2O.C30H18N2S.C29H17NO.C29H17NS.C25H16N2/c1-2-10-32(11-3-1)49-50-44-16-8-9-17-45(44)51(49)41-24-22-31(23-25-41)39-27-35-18-20-37-29-40(30-38-21-19-36(28-39)46(35)47(37)38)48-42-14-6-4-12-33(42)26-34-13-5-7-15-43(34)48;1-2-10-40(11-3-1)47-42-13-7-6-12-41(42)46-45(47)31-17-14-30(15-18-31)38-25-34-20-22-36-27-39(28-37-23-21-35(26-38)43(34)44(36)37)33-19-16-29-8-4-5-9-32(29)24-33;1-3-8-27(9-4-1)35-37-38-36(39(35)32-12-5-2-6-13-32)28-18-14-24(15-19-28)31-22-29-20-16-25-10-7-11-26-17-21-30(23-31)34(29)33(25)26;1-2-9-30(10-3-1)37-32-12-5-4-11-31(32)36-35(37)26-17-13-23(14-18-26)29-21-27-19-15-24-7-6-8-25-16-20-28(22-29)34(27)33(24)25;1-2-7-26(8-3-1)34-35(37-20-5-4-11-31(37)36-34)27-16-12-23(13-17-27)30-21-28-18-14-24-9-6-10-25-15-19-29(22-30)33(28)32(24)25;1-2-7-26(8-3-1)35-36-31-11-4-5-12-32(31)37(35)30-19-17-23(18-20-30)29-21-27-15-13-24-9-6-10-25-14-16-28(22-29)34(27)33(24)25;1-2-6-25(7-3-1)32-33(37-19-5-18-35-34(37)36-32)26-14-10-22(11-15-26)29-20-27-16-12-23-8-4-9-24-13-17-28(21-29)31(27)30(23)24;2*1-2-5-22(6-3-1)29-31-32-30(33-29)23-13-9-19(10-14-23)26-17-24-15-11-20-7-4-8-21-12-16-25(18-26)28(24)27(20)21;2*1-2-7-26-25(6-1)30-29(31-26)21-12-8-18(9-13-21)24-16-22-14-10-19-4-3-5-20-11-15-23(17-24)28(22)27(19)20;1-2-18-4-6-20-14-22(15-21-7-5-19(3-1)24(18)25(20)21)17-8-10-23(11-9-17)27-13-12-26-16-27/h1-30H;1-28,41-42H;1-23H;1-22,31-32H;2*1-22H;1-21H;2*1-18H;2*1-17H;1-16H.
What are the key properties of 1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole?
1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole has a molecular weight of 5640.90 g/mol, XLogP of 108.52, 36 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(7-anthracen-9-ylpyren-2-yl)phenyl]-2-phenylbenzimidazole;3,4-diphenyl-5-(4-pyren-2-ylphenyl)-1,2,4-triazole;2-[4-(7-naphthalen-2-ylpyren-2-yl)phenyl]-1-phenyl-3a,7a-dihydrobenzimidazole;1-phenyl-2-(4-pyren-2-ylphenyl)-3a,7a-dihydrobenzimidazole;2-phenyl-1-(4-pyren-2-ylphenyl)benzimidazole;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyridine;2-phenyl-3-(4-pyren-2-ylphenyl)imidazo[1,2-a]pyrimidine;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-oxadiazole;2-phenyl-5-(4-pyren-2-ylphenyl)-1,3,4-thiadiazole;2-(4-pyren-2-ylphenyl)-1,3-benzothiazole;2-(4-pyren-2-ylphenyl)-1,3-benzoxazole;1-(4-pyren-2-ylphenyl)imidazole is sourced from PubChem (CID 160930419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).