4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

C264H156N36O4S2 — CID 157128975

IUPAC4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
SMILESc1ccc(-n2c3cc(-c4ccc5oc6ccc(-c7ccc8c9ncccc9n(-c9ccccc9)c8c7)nc6c5n4)ccc3c3ncccc32)cc1.c1ccc(-n2c3cc(-c4ccc5sc6ccc(-c7ccc8c9cccnc9n(-c9ccccc9)c8c7)nc6c5n4)ccc3c3cccnc32)cc1.c1ccc(-n2c3ccncc3c3ccc(-c4ccc5oc6ccc(-c7ccc8c9cnccc9n(-c9ccccc9)c8c7)nc6c5n4)cc32)cc1.c1ccc(-n2c3cnccc3c3ccc(-c4ccc5oc6ccc(-c7ccc8c9cccnc9n(-c9ccccc9)c8c7)nc6c5n4)cc32)cc1.c1ccc(-n2c3cnccc3c3ccc(-c4ccc5oc6ccc(-c7ccc8c9ccncc9n(-c9ccccc9)c8c7)nc6c5n4)cc32)cc1.c1ccc(-n2c3cnccc3c3ccc(-c4ccc5sc6ccc(-c7ccc8c9ccncc9n(-c9ccccc9)c8c7)nc6c5n4)cc32)cc1
InChIInChI=1S/4C44H26N6O.2C44H26N6S/c1-3-9-29(10-4-1)49-35-13-7-23-45-41(35)31-17-15-27(25-37(31)49)33-19-21-39-43(47-33)44-40(51-39)22-20-34(48-44)28-16-18-32-38(26-28)50(30-11-5-2-6-12-30)36-14-8-24-46-42(32)36;1-3-8-29(9-4-1)49-37-24-27(13-15-31(37)33-21-23-45-26-39(33)49)35-17-19-40-42(47-35)43-41(51-40)20-18-36(48-43)28-14-16-32-34-12-7-22-46-44(34)50(38(32)25-28)30-10-5-2-6-11-30;1-3-7-29(8-4-1)49-37-19-21-45-25-33(37)31-13-11-27(23-39(31)49)35-15-17-41-43(47-35)44-42(51-41)18-16-36(48-44)28-12-14-32-34-26-46-22-20-38(34)50(40(32)24-28)30-9-5-2-6-10-30;1-3-7-29(8-4-1)49-37-23-27(11-13-31(37)33-19-21-45-25-39(33)49)35-15-17-41-43(47-35)44-42(51-41)18-16-36(48-44)28-12-14-32-34-20-22-46-26-40(34)50(38(32)24-28)30-9-5-2-6-10-30;1-3-9-29(10-4-1)49-37-25-27(15-17-31(37)33-13-7-23-45-43(33)49)35-19-21-39-41(47-35)42-40(51-39)22-20-36(48-42)28-16-18-32-34-14-8-24-46-44(34)50(38(32)26-28)30-11-5-2-6-12-30;1-3-7-29(8-4-1)49-37-23-27(11-13-31(37)33-19-21-45-25-39(33)49)35-15-17-41-43(47-35)44-42(51-41)18-16-36(48-44)28-12-14-32-34-20-22-46-26-40(34)50(38(32)24-28)30-9-5-2-6-10-30/h6*1-26H
InChIKeyAIVILJUNPXFJTQ-UHFFFAOYSA-N
MW3960.53 g/mol
LogP65.10
Rot. Bonds24

About 4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene

4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene (PubChem CID 157128975) has the molecular formula C264H156N36O4S2 and a molecular weight of 3960.53 g/mol. Its IUPAC name is 4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.

Molecular Properties

Compound Name4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
PubChem CID157128975
Molecular FormulaC264H156N36O4S2
Molecular Weight3960.53 g/mol
Exact Mass3957.26
IUPAC Name4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
SMILESc1ccc(-n2c3cc(-c4ccc5oc6ccc(-c7ccc8c9ncccc9n(-c9ccccc9)c8c7)nc6c5n4)ccc3c3ncccc32)cc1.c1ccc(-n2c3cc(-c4ccc5sc6ccc(-c7ccc8c9cccnc9n(-c9ccccc9)c8c7)nc6c5n4)ccc3c3cccnc32)cc1.c1ccc(-n2c3ccncc3c3ccc(-c4ccc5oc6ccc(-c7ccc8c9cnccc9n(-c9ccccc9)c8c7)nc6c5n4)cc32)cc1.c1ccc(-n2c3cnccc3c3ccc(-c4ccc5oc6ccc(-c7ccc8c9cccnc9n(-c9ccccc9)c8c7)nc6c5n4)cc32)cc1.c1ccc(-n2c3cnccc3c3ccc(-c4ccc5oc6ccc(-c7ccc8c9ccncc9n(-c9ccccc9)c8c7)nc6c5n4)cc32)cc1.c1ccc(-n2c3cnccc3c3ccc(-c4ccc5sc6ccc(-c7ccc8c9ccncc9n(-c9ccccc9)c8c7)nc6c5n4)cc32)cc1
InChIInChI=1S/4C44H26N6O.2C44H26N6S/c1-3-9-29(10-4-1)49-35-13-7-23-45-41(35)31-17-15-27(25-37(31)49)33-19-21-39-43(47-33)44-40(51-39)22-20-34(48-44)28-16-18-32-38(26-28)50(30-11-5-2-6-12-30)36-14-8-24-46-42(32)36;1-3-8-29(9-4-1)49-37-24-27(13-15-31(37)33-21-23-45-26-39(33)49)35-17-19-40-42(47-35)43-41(51-40)20-18-36(48-43)28-14-16-32-34-12-7-22-46-44(34)50(38(32)25-28)30-10-5-2-6-11-30;1-3-7-29(8-4-1)49-37-19-21-45-25-33(37)31-13-11-27(23-39(31)49)35-15-17-41-43(47-35)44-42(51-41)18-16-36(48-44)28-12-14-32-34-26-46-22-20-38(34)50(40(32)24-28)30-9-5-2-6-10-30;1-3-7-29(8-4-1)49-37-23-27(11-13-31(37)33-19-21-45-25-39(33)49)35-15-17-41-43(47-35)44-42(51-41)18-16-36(48-44)28-12-14-32-34-20-22-46-26-40(34)50(38(32)24-28)30-9-5-2-6-10-30;1-3-9-29(10-4-1)49-37-25-27(15-17-31(37)33-13-7-23-45-43(33)49)35-19-21-39-41(47-35)42-40(51-39)22-20-36(48-42)28-16-18-32-34-14-8-24-46-44(34)50(38(32)26-28)30-11-5-2-6-12-30;1-3-7-29(8-4-1)49-37-23-27(11-13-31(37)33-19-21-45-25-39(33)49)35-15-17-41-43(47-35)44-42(51-41)18-16-36(48-44)28-12-14-32-34-20-22-46-26-40(34)50(38(32)24-28)30-9-5-2-6-10-30/h6*1-26H
InChIKeyAIVILJUNPXFJTQ-UHFFFAOYSA-N
XLogP65.10
TPSA421.08 Ų
H-Bond Donors
H-Bond Acceptors42
Rotatable Bonds24
Heavy Atoms306
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003960.53
LogP ≤ 565.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1042

Analyze 4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene with MolForge

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Related Compounds

2,6-Bis([1]benzofuro[2,3-a]carbazol-12-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis[2,7-di(pyrimidin-2-yl)carbazol-9-yl]-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis[3,6-di(pyrimidin-2-yl)carbazol-9-yl]-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis[2-(6-phenyl-2-pyridinyl)carbazol-9-yl]-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis(2-pyrimidin-2-ylcarbazol-9-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile;2,6-bis(3-pyrimidin-2-ylcarbazol-9-yl)-4-[2-(trifluoromethyl)phenyl]benzonitrile
CID 157432745
N,N-bis[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-phenylbenzene-2-id-1-yl]-4,6-dimethylpyrimidin-5-amine;N,N-bis[3-[2-(2,6-dimethylphenyl)thieno[3,2-c]pyridin-4-yl]-5-phenylbenzene-2-id-1-yl]-2,4-dimethylpyridin-3-amine;N-[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-methylbenzene-2-id-1-yl]-N-[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-(trifluoromethyl)benzene-2-id-1-yl]-4,6-dimethylpyrimidin-5-amine;N-[3-(1-methylbenzimidazol-2-yl)benzene-2-id-1-yl]-3-phenyl-N-(2-phenylphenyl)-5-[2-(4-phenylphenyl)furo[3,2-c]pyridin-4-yl]benzene-6-id-1-amine;tetrakis(platinum(2+))
CID 157550492
1,2-Dimethylbenzimidazole;3,6-dimethylimidazo[4,5-b]pyridine;bis(2,5-dimethylpyridine);1,4-dimethylpyridin-2-one;ethane;2-(2-fluorophenyl)-4-methyl-1,3-thiazole;1-(3-isocyano-2-methylphenyl)ethanone;1-methylbenzimidazole;6-methylfuro[3,2-b]pyridine;1-methylindole;methyl 5-methylpyridine-2-carboxylate;2-methyl-1-phenylbenzimidazole;pentakis(2-methylpyrazine);6-methylpyrazolo[1,5-a]pyridine;2-methylpyridine;tris(3-methylpyridine);2-methylquinoline;5-methyl-2-(trifluoromethyl)pyridine;toluene
CID 158253580
N,N-bis[3-[2-(2,6-dimethylphenyl)furo[2,3-c]pyridin-7-yl]-5-phenylbenzene-2-id-1-yl]-4,6-dimethylpyrimidin-5-amine;N-[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-methylbenzene-2-id-1-yl]-N-[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-(trifluoromethyl)benzene-2-id-1-yl]-2,4-dimethylpyridin-3-amine;2-(2,6-dimethylphenyl)-7-[3-[3-[2-(2,6-dimethylphenyl)thieno[2,3-c]pyridin-7-yl]-5-phenylbenzene-2-id-1-yl]oxy-5-phenylbenzene-2-id-1-yl]thieno[2,3-c]pyridine;tris(platinum(2+))
CID 158307997
3-(2,5-Dimethylfuran-3-yl)-2,6,7-trimethylimidazo[4,5-b]pyridine;2,7-dimethyl-3-thiophen-3-ylimidazo[4,5-c]isoquinoline;2-ethyl-3-(5-methylthiophen-3-yl)-6-(trifluoromethyl)imidazo[4,5-b]pyridine;3-(furan-3-yl)-2,6-dimethylimidazo[4,5-b]pyridine;3-(5-methylfuran-3-yl)-2-phenyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;3-(5-methylfuran-3-yl)-2-phenyl-7-(trifluoromethyl)imidazo[4,5-c]isoquinoline;3-thiophen-3-ylimidazo[4,5-b]pyridine;3-thiophen-3-ylimidazo[4,5-b]quinoline;trimethyl-[2-methyl-3-(5-methylthiophen-3-yl)imidazo[4,5-b]pyridin-6-yl]silane;trimethyl-(2-methyl-3-thiophen-3-ylimidazo[4,5-b]pyridin-6-yl)silane
CID 158564451
6-Tert-butyl-3-(4-methylthiophen-3-yl)-5-phenylimidazo[4,5-b]pyridine;3-(4,5-dimethylfuran-3-yl)imidazo[4,5-b]pyridine;3-(3,4-dimethylphenyl)-2,6-bis(trifluoromethyl)imidazo[4,5-b]pyridine;2,6-di(propan-2-yl)-3-thiophen-3-ylimidazo[4,5-b]pyridine;2-ethyl-6-methyl-3-(5-methylthiophen-3-yl)imidazo[4,5-b]pyridine;3-(furan-3-yl)-2,6-dimethylimidazo[4,5-b]pyridine;3-(furan-3-yl)-2,6-di(propan-2-yl)imidazo[4,5-b]pyridine;2-methyl-3-(5-methylthiophen-3-yl)-6-phenylimidazo[4,5-b]pyridine;3-(4-methylphenyl)-2-phenyl-7-(trifluoromethyl)imidazo[4,5-c]isoquinoline
CID 159358416
9-[4-[4-(4-Dibenzofuran-2-ylphenyl)-6-(9,9-dimethylfluoren-2-yl)pyrimidin-2-yl]phenyl]carbazole;9-(4-dibenzothiophen-2-yl-6-phenylpyrimidin-2-yl)carbazole;9-(4-dibenzothiophen-4-yl-6-phenylpyrimidin-2-yl)carbazole;8-[4-[4-phenyl-6-[4-(9-phenylcarbazol-3-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-3-(trifluoromethyl)-[1]benzofuro[3,2-b]pyridine
CID 160034025
12-[3-([1]Benzofuro[2,3-a]carbazol-12-yl)-2-isocyano-4-[2-isocyano-6-(trifluoromethyl)phenyl]phenyl]-[1]benzofuro[2,3-a]carbazole;2,6-bis([1]benzofuro[3,2-a]carbazol-12-yl)-3-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;2,6-bis([1]benzothiolo[3,2-a]carbazol-12-yl)-3-[2-isocyano-6-(trifluoromethyl)phenyl]benzonitrile;9-[3-[2,7-di(pyrimidin-2-yl)carbazol-9-yl]-2-isocyano-4-[2-isocyano-6-(trifluoromethyl)phenyl]phenyl]-2,7-di(pyrimidin-2-yl)carbazole;9-[2-isocyano-4-[2-isocyano-6-(trifluoromethyl)phenyl]-3-(3-pyrimidin-2-ylcarbazol-9-yl)phenyl]-3-pyrimidin-2-ylcarbazole;3-[2-isocyano-6-(trifluoromethyl)phenyl]-2,6-bis(2-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 160542497
2-(1-benzothiophen-2-yl)pyridine;2-[3,5-bis(trifluoromethyl)phenyl]pyridine;2-(2,4-difluorophenyl)-N,N-dimethylpyridin-4-amine;2-(2,4-difluorophenyl)-4-methoxypyridine;2-(2,4-difluorophenyl)pyridine;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;bis(2-phenylpyridine);2-thiophen-2-yl-5-(trifluoromethyl)pyridine
CID 160694799
N,N-bis[3-[2-(2,6-dimethylphenyl)furo[2,3-c]pyridin-7-yl]-5-phenylbenzene-2-id-1-yl]-4,6-dimethylpyrimidin-5-amine;N-[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-methylbenzene-2-id-1-yl]-N-[3-[2-(4-tert-butylphenyl)furo[2,3-c]pyridin-7-yl]-5-(trifluoromethyl)benzene-2-id-1-yl]-2,4-dimethylpyridin-3-amine;2-(2,6-dimethylphenyl)-7-[3-[3-[2-(2,6-dimethylphenyl)thieno[2,3-c]pyridin-7-yl]-5-phenylbenzene-2-id-1-yl]oxy-5-phenylbenzene-2-id-1-yl]thieno[2,3-c]pyridine;N-[3-[2-(2,6-dimethylphenyl)furo[2,3-c]pyridin-7-yl]-5-methylbenzene-2-id-1-yl]-N-[3-[2-(2,6-dimethylphenyl)furo[2,3-c]pyridin-7-yl]-5-(trifluoromethyl)benzene-2-id-1-yl]-2,4-dimethylpyridin-3-amine;tetrakis(platinum(2+))
CID 161803877
2,4-dimethylfuro[3,2-c]pyridine;1,2-dimethylimidazole;2,5-dimethyl-1H-imidazole;1,4-dimethylindole;2,4-dimethyl-1H-pyrrolo[3,2-c]pyridine;5-fluoro-4-methyl-7H-pyrrolo[2,3-d]pyrimidine;methane;4-methylfuro[3,2-c]pyridine;4-methyl-1H-indole;1-methylisoquinoline;4-(1-methylisoquinolin-3-yl)morpholine;7-methyl-[1,2]oxazolo[5,4-c]pyridine;2-methyl-3-prop-1-enylpyridine;4-methylquinazoline;4-(4-methylquinazolin-2-yl)morpholine;4-methylthieno[2,3-d]pyrimidine;4-methyl-6-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine
CID 161865812
2-[3-Anthracen-9-yl-5-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]phenyl]-1,3-benzoxazole;2-[4-anthracen-9-yl-6-[3-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)phenyl]-2-pyridinyl]-1,3-benzoxazole;2-[3-[3-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-5-(1,10-phenanthrolin-5-yl)phenyl]-1,3-benzothiazole;2-[3-(1,10-phenanthrolin-5-yl)-5-[3-[4-phenyl-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]phenyl]phenyl]-1,3-benzothiazole;2-[6-[3-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)phenyl]-2-quinoxalin-5-ylpyrimidin-4-yl]-1,3-benzoxazole
CID 161951747

Frequently Asked Questions

What is the IUPAC name of 4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
The IUPAC name of 4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene (CID 157128975) is 4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.
What is the SMILES notation for 4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
The canonical SMILES for 4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene is c1ccc(-n2c3cc(-c4ccc5oc6ccc(-c7ccc8c9ncccc9n(-c9ccccc9)c8c7)nc6c5n4)ccc3c3ncccc32)cc1.c1ccc(-n2c3cc(-c4ccc5sc6ccc(-c7ccc8c9cccnc9n(-c9ccccc9)c8c7)nc6c5n4)ccc3c3cccnc32)cc1.c1ccc(-n2c3ccncc3c3ccc(-c4ccc5oc6ccc(-c7ccc8c9cnccc9n(-c9ccccc9)c8c7)nc6c5n4)cc32)cc1.c1ccc(-n2c3cnccc3c3ccc(-c4ccc5oc6ccc(-c7ccc8c9cccnc9n(-c9ccccc9)c8c7)nc6c5n4)cc32)cc1.c1ccc(-n2c3cnccc3c3ccc(-c4ccc5oc6ccc(-c7ccc8c9ccncc9n(-c9ccccc9)c8c7)nc6c5n4)cc32)cc1.c1ccc(-n2c3cnccc3c3ccc(-c4ccc5sc6ccc(-c7ccc8c9ccncc9n(-c9ccccc9)c8c7)nc6c5n4)cc32)cc1.
What is the InChIKey of 4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
The InChIKey is AIVILJUNPXFJTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/4C44H26N6O.2C44H26N6S/c1-3-9-29(10-4-1)49-35-13-7-23-45-41(35)31-17-15-27(25-37(31)49)33-19-21-39-43(47-33)44-40(51-39)22-20-34(48-44)28-16-18-32-38(26-28)50(30-11-5-2-6-12-30)36-14-8-24-46-42(32)36;1-3-8-29(9-4-1)49-37-24-27(13-15-31(37)33-21-23-45-26-39(33)49)35-17-19-40-42(47-35)43-41(51-40)20-18-36(48-43)28-14-16-32-34-12-7-22-46-44(34)50(38(32)25-28)30-10-5-2-6-11-30;1-3-7-29(8-4-1)49-37-19-21-45-25-33(37)31-13-11-27(23-39(31)49)35-15-17-41-43(47-35)44-42(51-41)18-16-36(48-44)28-12-14-32-34-26-46-22-20-38(34)50(40(32)24-28)30-9-5-2-6-10-30;1-3-7-29(8-4-1)49-37-23-27(11-13-31(37)33-19-21-45-25-39(33)49)35-15-17-41-43(47-35)44-42(51-41)18-16-36(48-44)28-12-14-32-34-20-22-46-26-40(34)50(38(32)24-28)30-9-5-2-6-10-30;1-3-9-29(10-4-1)49-37-25-27(15-17-31(37)33-13-7-23-45-43(33)49)35-19-21-39-41(47-35)42-40(51-39)22-20-36(48-42)28-16-18-32-34-14-8-24-46-44(34)50(38(32)26-28)30-11-5-2-6-12-30;1-3-7-29(8-4-1)49-37-23-27(11-13-31(37)33-19-21-45-25-39(33)49)35-15-17-41-43(47-35)44-42(51-41)18-16-36(48-44)28-12-14-32-34-20-22-46-26-40(34)50(38(32)24-28)30-9-5-2-6-10-30/h6*1-26H.
What are the key properties of 4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene?
4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene has a molecular weight of 3960.53 g/mol, XLogP of 65.10, 24 rotatable bonds, 0 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 4,12-bis(5-phenylpyrido[3,2-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(5-phenylpyrido[4,3-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[2,3-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4,12-bis(9-phenylpyrido[3,4-b]indol-7-yl)-8-thia-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(9-phenylpyrido[2,3-b]indol-7-yl)-12-(9-phenylpyrido[3,4-b]indol-7-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene is sourced from PubChem (CID 157128975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).