2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine

C436H280N24O3S — CID 158936322

IUPAC2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine
SMILESCn1c(-c2cc3ccc4ccccc4c3c3ccccc23)nc2ccccc21.Cn1cnc2cccc(-c3cc4ccc5cc(-c6ccccc6)ccc5c4c4ccccc34)c21.Cn1cnc2cccc(-c3cc4ccccc4c4c3ccc3cc(-c5ccccc5)ccc34)c21.c1ccc(-c2cc(-c3cc4ccc5ccccc5c4c4ccccc34)cc3ccncc23)cc1.c1ccc(-c2ccc(-c3cc4ccc5ccccc5c4c4ccccc34)c3ncccc23)cc1.c1ccc(-c2ccc3c(ccc4c(-c5cccc6ncoc56)cc5ccccc5c43)c2)cc1.c1ccc(-c2ccc3c(ccc4cc(-c5cccc6ncoc56)c5ccccc5c43)c2)cc1.c1ccc(-c2ccc3c(ccc4cc(-c5cccc6ncsc56)c5ccccc5c43)c2)cc1.c1ccc(-c2ccnc(-c3cc4ccc5ccccc5c4c4ccccc34)c2)cc1.c1ccc(-c2ccnc(-c3cc4ccc5ccccc5c4c4ccccc34)n2)cc1.c1ccc(-c2ccnc(-c3ccc4c(ccc5cc(-c6cc(-c7ccccc7)ccn6)c6ccccc6c54)c3)c2)cc1.c1ccc(-c2ccnc(-c3ccc4c(ccc5cc(-c6nccc(-c7ccccc7)n6)c6ccccc6c54)c3)n2)cc1.c1ccc(-c2ncnc(-c3cc4ccc5ccccc5c4c4ccccc34)n2)cc1.c1ccc2c(c1)ccc1cc(-c3nc4ccccc4o3)c3ccccc3c12
InChIInChI=1S/C40H26N2.C38H24N4.2C33H21N.2C32H22N2.2C31H19NO.C31H19NS.C29H19N.C28H18N2.C27H17N3.C26H18N2.C25H15NO/c1-3-9-27(10-4-1)29-19-21-41-38(25-29)32-17-18-34-31(23-32)15-16-33-24-37(35-13-7-8-14-36(35)40(33)34)39-26-30(20-22-42-39)28-11-5-2-6-12-28;1-3-9-25(10-4-1)34-19-21-39-37(41-34)29-17-18-30-27(23-29)15-16-28-24-33(31-13-7-8-14-32(31)36(28)30)38-40-22-20-35(42-38)26-11-5-2-6-12-26;1-2-9-22(10-3-1)25-18-19-30(33-29(25)15-8-20-34-33)31-21-24-17-16-23-11-4-5-12-26(23)32(24)28-14-7-6-13-27(28)31;1-2-8-22(9-3-1)30-20-26(18-24-16-17-34-21-32(24)30)31-19-25-15-14-23-10-4-5-11-27(23)33(25)29-13-7-6-12-28(29)31;1-34-20-33-30-13-7-12-28(32(30)34)29-19-23-10-5-6-11-25(23)31-26-16-14-22(21-8-3-2-4-9-21)18-24(26)15-17-27(29)31;1-34-20-33-30-13-7-12-28(32(30)34)29-19-24-15-14-23-18-22(21-8-3-2-4-9-21)16-17-25(23)31(24)27-11-6-5-10-26(27)29;1-2-7-20(8-3-1)21-13-15-25-23(17-21)14-16-26-28(18-22-9-4-5-10-24(22)30(25)26)27-11-6-12-29-31(27)33-19-32-29;2*1-2-7-20(8-3-1)21-15-16-24-22(17-21)13-14-23-18-28(25-9-4-5-10-26(25)30(23)24)27-11-6-12-29-31(27)33-19-32-29;1-2-8-20(9-3-1)22-16-17-30-28(19-22)27-18-23-15-14-21-10-4-5-11-24(21)29(23)26-13-7-6-12-25(26)27;1-2-9-20(10-3-1)26-16-17-29-28(30-26)25-18-21-15-14-19-8-4-5-11-22(19)27(21)24-13-7-6-12-23(24)25;1-2-9-19(10-3-1)26-28-17-29-27(30-26)24-16-20-15-14-18-8-4-5-11-21(18)25(20)23-13-7-6-12-22(23)24;1-28-24-13-7-6-12-23(24)27-26(28)22-16-18-15-14-17-8-2-3-9-19(17)25(18)21-11-5-4-10-20(21)22;1-2-8-18-16(7-1)13-14-17-15-21(19-9-3-4-10-20(19)24(17)18)25-26-22-11-5-6-12-23(22)27-25/h1-26H;1-24H;2*1-21H;2*2-20H,1H3;3*1-19H;1-19H;1-18H;1-17H;2-16H,1H3;1-15H
InChIKeyJJRPYKOANJKYLI-UHFFFAOYSA-N
MW5935.27 g/mol
LogP116.59
Rot. Bonds30

About 2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine

2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine (PubChem CID 158936322) has the molecular formula C436H280N24O3S and a molecular weight of 5935.27 g/mol. Its IUPAC name is 2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine.

Molecular Properties

Compound Name2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine
PubChem CID158936322
Molecular FormulaC436H280N24O3S
Molecular Weight5935.27 g/mol
Exact Mass5930.22
IUPAC Name2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine
SMILESCn1c(-c2cc3ccc4ccccc4c3c3ccccc23)nc2ccccc21.Cn1cnc2cccc(-c3cc4ccc5cc(-c6ccccc6)ccc5c4c4ccccc34)c21.Cn1cnc2cccc(-c3cc4ccccc4c4c3ccc3cc(-c5ccccc5)ccc34)c21.c1ccc(-c2cc(-c3cc4ccc5ccccc5c4c4ccccc34)cc3ccncc23)cc1.c1ccc(-c2ccc(-c3cc4ccc5ccccc5c4c4ccccc34)c3ncccc23)cc1.c1ccc(-c2ccc3c(ccc4c(-c5cccc6ncoc56)cc5ccccc5c43)c2)cc1.c1ccc(-c2ccc3c(ccc4cc(-c5cccc6ncoc56)c5ccccc5c43)c2)cc1.c1ccc(-c2ccc3c(ccc4cc(-c5cccc6ncsc56)c5ccccc5c43)c2)cc1.c1ccc(-c2ccnc(-c3cc4ccc5ccccc5c4c4ccccc34)c2)cc1.c1ccc(-c2ccnc(-c3cc4ccc5ccccc5c4c4ccccc34)n2)cc1.c1ccc(-c2ccnc(-c3ccc4c(ccc5cc(-c6cc(-c7ccccc7)ccn6)c6ccccc6c54)c3)c2)cc1.c1ccc(-c2ccnc(-c3ccc4c(ccc5cc(-c6nccc(-c7ccccc7)n6)c6ccccc6c54)c3)n2)cc1.c1ccc(-c2ncnc(-c3cc4ccc5ccccc5c4c4ccccc34)n2)cc1.c1ccc2c(c1)ccc1cc(-c3nc4ccccc4o3)c3ccccc3c12
InChIInChI=1S/C40H26N2.C38H24N4.2C33H21N.2C32H22N2.2C31H19NO.C31H19NS.C29H19N.C28H18N2.C27H17N3.C26H18N2.C25H15NO/c1-3-9-27(10-4-1)29-19-21-41-38(25-29)32-17-18-34-31(23-32)15-16-33-24-37(35-13-7-8-14-36(35)40(33)34)39-26-30(20-22-42-39)28-11-5-2-6-12-28;1-3-9-25(10-4-1)34-19-21-39-37(41-34)29-17-18-30-27(23-29)15-16-28-24-33(31-13-7-8-14-32(31)36(28)30)38-40-22-20-35(42-38)26-11-5-2-6-12-26;1-2-9-22(10-3-1)25-18-19-30(33-29(25)15-8-20-34-33)31-21-24-17-16-23-11-4-5-12-26(23)32(24)28-14-7-6-13-27(28)31;1-2-8-22(9-3-1)30-20-26(18-24-16-17-34-21-32(24)30)31-19-25-15-14-23-10-4-5-11-27(23)33(25)29-13-7-6-12-28(29)31;1-34-20-33-30-13-7-12-28(32(30)34)29-19-23-10-5-6-11-25(23)31-26-16-14-22(21-8-3-2-4-9-21)18-24(26)15-17-27(29)31;1-34-20-33-30-13-7-12-28(32(30)34)29-19-24-15-14-23-18-22(21-8-3-2-4-9-21)16-17-25(23)31(24)27-11-6-5-10-26(27)29;1-2-7-20(8-3-1)21-13-15-25-23(17-21)14-16-26-28(18-22-9-4-5-10-24(22)30(25)26)27-11-6-12-29-31(27)33-19-32-29;2*1-2-7-20(8-3-1)21-15-16-24-22(17-21)13-14-23-18-28(25-9-4-5-10-26(25)30(23)24)27-11-6-12-29-31(27)33-19-32-29;1-2-8-20(9-3-1)22-16-17-30-28(19-22)27-18-23-15-14-21-10-4-5-11-24(21)29(23)26-13-7-6-12-25(26)27;1-2-9-20(10-3-1)26-16-17-29-28(30-26)25-18-21-15-14-19-8-4-5-11-22(19)27(21)24-13-7-6-12-23(24)25;1-2-9-19(10-3-1)26-28-17-29-27(30-26)24-16-20-15-14-18-8-4-5-11-21(18)25(20)23-13-7-6-12-22(23)24;1-28-24-13-7-6-12-23(24)27-26(28)22-16-18-15-14-17-8-2-3-9-19(17)25(18)21-11-5-4-10-20(21)22;1-2-8-18-16(7-1)13-14-17-15-21(19-9-3-4-10-20(19)24(17)18)25-26-22-11-5-6-12-23(22)27-25/h1-26H;1-24H;2*1-21H;2*2-20H,1H3;3*1-19H;1-19H;1-18H;1-17H;2-16H,1H3;1-15H
InChIKeyJJRPYKOANJKYLI-UHFFFAOYSA-N
XLogP116.59
TPSA324.90 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds30
Heavy Atoms464
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005935.27
LogP ≤ 5116.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Analyze 2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine with MolForge

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Related Compounds

1-Cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;9-phenyl-4-propan-2-ylcarbazole;1-phenyl-2-(4-propan-2-ylphenyl)benzimidazole;4-propan-2-ylbenzonitrile;5-propan-2-yl-1,2-dihydroacenaphthylene;1-propan-2-ylisoquinoline;2-(4-propan-2-ylphenyl)-1,3-benzothiazole;2-(4-propan-2-ylphenyl)-1,3-benzoxazole;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylquinoline;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane
CID 157063515
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
benzene-1,2-dicarbonitrile;1,3-benzothiazole;1-benzothiophene;1,3-benzoxazole;1,2-bis(trifluoromethyl)benzene;5H-cyclopenta[c]pyridine;3H-indazole;isoindole-1,3-dione;4H-naphthalen-1-one;1,5-naphthyridine;1,6-naphthyridine;1,7-naphthyridine;1,8-naphthyridine;2-phenyl-1,3-benzoxazole;pyrido[3,4-b]pyrazine;pyrido[2,3-d]pyridazine;quinazoline;1,2,3-tris(trifluoromethyl)benzene
CID 157751392
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
6-fluoro-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1,3-benzothiazol-2-amine;6-fluoro-N-[2-[4-[(2-propan-2-yloxyphenyl)methyl]piperazin-1-yl]ethyl]-1,3-benzothiazol-2-amine;N-[4-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]butyl]-1,3-benzothiazol-2-amine;1-methyl-2-[3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]benzimidazole;N-[2-(4-naphthalen-2-ylpiperazin-1-yl)ethyl]-1,3-benzothiazol-2-amine;N-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-benzoxazol-2-amine
CID 157832980
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
2,5-Dimethyl-1,3-benzothiazole;1-methoxy-4-methylbenzene;5-methyl-1,3-benzothiazole;3-methyl-1-benzothiophene;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-5-phenyl-1,2,4-oxadiazole;2-methylpyrazine;2-methylpyrimidine;2-methyl-[1,3]thiazolo[5,4-b]pyridine;2-methyl-4-thiophen-2-ylpyrimidine;2-methyl-5-(trifluoromethyl)pyridine
CID 158298930
benzaldehyde;benzonitrile;1,3-benzothiazole;1-benzothiophene;1,3-benzoxazole;2-(1,1-difluoroethyl)-1,3-bis(trifluoromethyl)benzene;3H-indole;4-methylidenecyclopent-2-en-1-one;4H-naphthalen-1-one;1,6-naphthyridine;phenanthridine;1H-phenanthro[9,10-d]imidazole;1,10-phenanthroline;2-phenyl-1,3-benzoxazole;2-pyridin-2-ylpyridine;quinoline
CID 158538440
CID 158633368
CID 158633368
1-(1,1-Difluoroethyl)-3-methyl-5-(trifluoromethyl)benzene;2,6-dimethyl-1,3-benzothiazole;2,5-dimethyl-1-benzothiophene;2,6-dimethyl-1,3-benzoxazole;3,7-dimethylimidazo[4,5-f]benzimidazole;2,3-dimethyl-1,10-phenanthroline;10-methylacridin-9-one;4-methylbenzene-1,2-dicarbonitrile;4-methyl-[1]benzothiolo[2,3-b]pyridine;9-methylcarbazole;4-methyldibenzothiophene;6-methyl-2-phenyl-1,3-benzoxazole;1-(4-methylphenyl)ethanone;9-methylpyrido[2,3-b]indole;3-methylquinoline;8-methyl-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;2,2,2-trifluoro-1-(3-methylphenyl)ethanone
CID 158821818
1-benzyl-4-propan-2-ylpiperidine;tert-butyl 4-(2-propan-2-ylphenyl)piperazine-1-carboxylate;cumene;1,4-dimethoxy-2-propan-2-ylbenzene;N,N-dimethyl-3-propan-2-ylpyridin-2-amine;1-ethyl-4-propan-2-ylbenzene;1-ethynyl-2-propan-2-ylbenzene;1-ethynyl-4-propan-2-ylbenzene;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;4-propan-2-ylbenzoic acid;6-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1,8-naphthyridine;4-propan-2-yloxane;2-propan-2-yl-1,3-oxazole;(2-propan-2-ylphenyl)boronic acid;2-(3-propan-2-ylphenyl)pyridine;4-(4-propan-2-ylphenyl)thiomorpholine;5-propan-2-ylpyrimidine;5-propan-2-ylquinoline;6-propan-2-ylquinoxaline;4-propan-2-yl-1,3-thiazole;1,1,1-trifluoro-3-methylbutane
CID 159124080

Frequently Asked Questions

What is the IUPAC name of 2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine?
The IUPAC name of 2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine (CID 158936322) is 2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine.
What is the SMILES notation for 2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine?
The canonical SMILES for 2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine is Cn1c(-c2cc3ccc4ccccc4c3c3ccccc23)nc2ccccc21.Cn1cnc2cccc(-c3cc4ccc5cc(-c6ccccc6)ccc5c4c4ccccc34)c21.Cn1cnc2cccc(-c3cc4ccccc4c4c3ccc3cc(-c5ccccc5)ccc34)c21.c1ccc(-c2cc(-c3cc4ccc5ccccc5c4c4ccccc34)cc3ccncc23)cc1.c1ccc(-c2ccc(-c3cc4ccc5ccccc5c4c4ccccc34)c3ncccc23)cc1.c1ccc(-c2ccc3c(ccc4c(-c5cccc6ncoc56)cc5ccccc5c43)c2)cc1.c1ccc(-c2ccc3c(ccc4cc(-c5cccc6ncoc56)c5ccccc5c43)c2)cc1.c1ccc(-c2ccc3c(ccc4cc(-c5cccc6ncsc56)c5ccccc5c43)c2)cc1.c1ccc(-c2ccnc(-c3cc4ccc5ccccc5c4c4ccccc34)c2)cc1.c1ccc(-c2ccnc(-c3cc4ccc5ccccc5c4c4ccccc34)n2)cc1.c1ccc(-c2ccnc(-c3ccc4c(ccc5cc(-c6cc(-c7ccccc7)ccn6)c6ccccc6c54)c3)c2)cc1.c1ccc(-c2ccnc(-c3ccc4c(ccc5cc(-c6nccc(-c7ccccc7)n6)c6ccccc6c54)c3)n2)cc1.c1ccc(-c2ncnc(-c3cc4ccc5ccccc5c4c4ccccc34)n2)cc1.c1ccc2c(c1)ccc1cc(-c3nc4ccccc4o3)c3ccccc3c12.
What is the InChIKey of 2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine?
The InChIKey is JJRPYKOANJKYLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H26N2.C38H24N4.2C33H21N.2C32H22N2.2C31H19NO.C31H19NS.C29H19N.C28H18N2.C27H17N3.C26H18N2.C25H15NO/c1-3-9-27(10-4-1)29-19-21-41-38(25-29)32-17-18-34-31(23-32)15-16-33-24-37(35-13-7-8-14-36(35)40(33)34)39-26-30(20-22-42-39)28-11-5-2-6-12-28;1-3-9-25(10-4-1)34-19-21-39-37(41-34)29-17-18-30-27(23-29)15-16-28-24-33(31-13-7-8-14-32(31)36(28)30)38-40-22-20-35(42-38)26-11-5-2-6-12-26;1-2-9-22(10-3-1)25-18-19-30(33-29(25)15-8-20-34-33)31-21-24-17-16-23-11-4-5-12-26(23)32(24)28-14-7-6-13-27(28)31;1-2-8-22(9-3-1)30-20-26(18-24-16-17-34-21-32(24)30)31-19-25-15-14-23-10-4-5-11-27(23)33(25)29-13-7-6-12-28(29)31;1-34-20-33-30-13-7-12-28(32(30)34)29-19-23-10-5-6-11-25(23)31-26-16-14-22(21-8-3-2-4-9-21)18-24(26)15-17-27(29)31;1-34-20-33-30-13-7-12-28(32(30)34)29-19-24-15-14-23-18-22(21-8-3-2-4-9-21)16-17-25(23)31(24)27-11-6-5-10-26(27)29;1-2-7-20(8-3-1)21-13-15-25-23(17-21)14-16-26-28(18-22-9-4-5-10-24(22)30(25)26)27-11-6-12-29-31(27)33-19-32-29;2*1-2-7-20(8-3-1)21-15-16-24-22(17-21)13-14-23-18-28(25-9-4-5-10-26(25)30(23)24)27-11-6-12-29-31(27)33-19-32-29;1-2-8-20(9-3-1)22-16-17-30-28(19-22)27-18-23-15-14-21-10-4-5-11-24(21)29(23)26-13-7-6-12-25(26)27;1-2-9-20(10-3-1)26-16-17-29-28(30-26)25-18-21-15-14-19-8-4-5-11-22(19)27(21)24-13-7-6-12-23(24)25;1-2-9-19(10-3-1)26-28-17-29-27(30-26)24-16-20-15-14-18-8-4-5-11-21(18)25(20)23-13-7-6-12-22(23)24;1-28-24-13-7-6-12-23(24)27-26(28)22-16-18-15-14-17-8-2-3-9-19(17)25(18)21-11-5-4-10-20(21)22;1-2-8-18-16(7-1)13-14-17-15-21(19-9-3-4-10-20(19)24(17)18)25-26-22-11-5-6-12-23(22)27-25/h1-26H;1-24H;2*1-21H;2*2-20H,1H3;3*1-19H;1-19H;1-18H;1-17H;2-16H,1H3;1-15H.
What are the key properties of 2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine?
2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine has a molecular weight of 5935.27 g/mol, XLogP of 116.59, 30 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzo[c]phenanthren-5-yl-1,3-benzoxazole;2-benzo[c]phenanthren-5-yl-1-methylbenzimidazole;6-benzo[c]phenanthren-5-yl-8-phenylisoquinoline;2-benzo[c]phenanthren-5-yl-4-phenylpyridine;2-benzo[c]phenanthren-5-yl-4-phenylpyrimidine;8-benzo[c]phenanthren-5-yl-5-phenylquinoline;2-benzo[c]phenanthren-5-yl-4-phenyl-1,3,5-triazine;1-methyl-7-(3-phenylbenzo[c]phenanthren-7-yl)benzimidazole;1-methyl-7-(3-phenylbenzo[c]phenanthren-8-yl)benzimidazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzothiazole;7-(3-phenylbenzo[c]phenanthren-7-yl)-1,3-benzoxazole;7-(3-phenylbenzo[c]phenanthren-8-yl)-1,3-benzoxazole;4-phenyl-2-[3-(4-phenyl-2-pyridinyl)benzo[c]phenanthren-8-yl]pyridine;4-phenyl-2-[3-(4-phenylpyrimidin-2-yl)benzo[c]phenanthren-8-yl]pyrimidine is sourced from PubChem (CID 158936322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).