5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine

C315H222N12O5S3Si — CID 159634634

IUPAC5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)Oc3cccc5c(-c6ccc(N(c7ccccc7)c7ccccc7)c7ccccc67)ccc-4c35)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)Sc3cccc5c(N(c6ccccc6)c6ccccc6)ccc-4c35)cc21.C[Si](C)(C)c1ccc(N(c2ccccc2)c2ccc3cc(-c4ccc5c6c(cccc46)Oc4cc(N(c6ccccc6-c6ccccc6)c6cccc7c6oc6ccccc67)ccc4-5)ccc3c2)cc1.c1ccc(-c2ccccc2N(c2ccc3c(c2)Sc2cccc4c(N(c5ccccc5)c5ccccc5)ccc-3c24)c2cccc3c2oc2ccccc23)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)Oc2cccc4c(-c5ccc(N(c6ccccc6)c6ccccc6)c6ccccc56)ccc-3c24)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)Sc2cccc4c(N(c5ccccc5)c5ccccc5)ccc-3c24)cc1
InChIInChI=1S/C65H48N2O2Si.C59H42N2O.C52H34N2OS.C50H34N2O.C49H36N2S.C40H28N2S/c1-70(2,3)51-35-32-48(33-36-51)66(47-18-8-5-9-19-47)49-31-30-44-40-46(29-28-45(44)41-49)52-38-39-57-55-37-34-50(42-63(55)68-62-27-15-22-56(52)64(57)62)67(59-24-12-10-20-53(59)43-16-6-4-7-17-43)60-25-14-23-58-54-21-11-13-26-61(54)69-65(58)60;1-59(2)53-27-15-14-24-47(53)48-31-29-42(37-54(48)59)60(39-17-6-3-7-18-39)43-30-32-50-52-34-33-46(51-26-16-28-56(58(51)52)62-57(50)38-43)45-35-36-55(49-25-13-12-23-44(45)49)61(40-19-8-4-9-20-40)41-21-10-5-11-22-41;1-4-16-35(17-5-1)39-22-10-12-26-45(39)54(47-27-14-24-43-40-23-11-13-28-48(40)55-52(43)47)38-30-31-41-42-32-33-46(44-25-15-29-49(51(42)44)56-50(41)34-38)53(36-18-6-2-7-19-36)37-20-8-3-9-21-37;1-5-16-35(17-6-1)51(36-18-7-2-8-19-36)39-28-29-44-46-31-30-42(45-26-15-27-48(50(45)46)53-49(44)34-39)41-32-33-47(43-25-14-13-24-40(41)43)52(37-20-9-3-10-21-37)38-22-11-4-12-23-38;1-49(2)43-23-13-12-21-38(43)39-27-25-36(31-44(39)49)50(33-15-6-3-7-16-33)37-26-28-40-41-29-30-45(42-22-14-24-46(48(41)42)52-47(40)32-37)51(34-17-8-4-9-18-34)35-19-10-5-11-20-35;1-5-14-29(15-6-1)41(30-16-7-2-8-17-30)33-24-25-34-35-26-27-37(36-22-13-23-38(40(35)36)43-39(34)28-33)42(31-18-9-3-10-19-31)32-20-11-4-12-21-32/h4-42H,1-3H3;3-38H,1-2H3;1-34H;1-34H;3-32H,1-2H3;1-28H
InChIKeyMPOQLMHVMCHTQV-UHFFFAOYSA-N
MW4379.61 g/mol
LogP91.14
Rot. Bonds42

About 5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine

5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine (PubChem CID 159634634) has the molecular formula C315H222N12O5S3Si and a molecular weight of 4379.61 g/mol. Its IUPAC name is 5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine.

Molecular Properties

Compound Name5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine
PubChem CID159634634
Molecular FormulaC315H222N12O5S3Si
Molecular Weight4379.61 g/mol
Exact Mass4375.64
IUPAC Name5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)Oc3cccc5c(-c6ccc(N(c7ccccc7)c7ccccc7)c7ccccc67)ccc-4c35)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)Sc3cccc5c(N(c6ccccc6)c6ccccc6)ccc-4c35)cc21.C[Si](C)(C)c1ccc(N(c2ccccc2)c2ccc3cc(-c4ccc5c6c(cccc46)Oc4cc(N(c6ccccc6-c6ccccc6)c6cccc7c6oc6ccccc67)ccc4-5)ccc3c2)cc1.c1ccc(-c2ccccc2N(c2ccc3c(c2)Sc2cccc4c(N(c5ccccc5)c5ccccc5)ccc-3c24)c2cccc3c2oc2ccccc23)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)Oc2cccc4c(-c5ccc(N(c6ccccc6)c6ccccc6)c6ccccc56)ccc-3c24)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)Sc2cccc4c(N(c5ccccc5)c5ccccc5)ccc-3c24)cc1
InChIInChI=1S/C65H48N2O2Si.C59H42N2O.C52H34N2OS.C50H34N2O.C49H36N2S.C40H28N2S/c1-70(2,3)51-35-32-48(33-36-51)66(47-18-8-5-9-19-47)49-31-30-44-40-46(29-28-45(44)41-49)52-38-39-57-55-37-34-50(42-63(55)68-62-27-15-22-56(52)64(57)62)67(59-24-12-10-20-53(59)43-16-6-4-7-17-43)60-25-14-23-58-54-21-11-13-26-61(54)69-65(58)60;1-59(2)53-27-15-14-24-47(53)48-31-29-42(37-54(48)59)60(39-17-6-3-7-18-39)43-30-32-50-52-34-33-46(51-26-16-28-56(58(51)52)62-57(50)38-43)45-35-36-55(49-25-13-12-23-44(45)49)61(40-19-8-4-9-20-40)41-21-10-5-11-22-41;1-4-16-35(17-5-1)39-22-10-12-26-45(39)54(47-27-14-24-43-40-23-11-13-28-48(40)55-52(43)47)38-30-31-41-42-32-33-46(44-25-15-29-49(51(42)44)56-50(41)34-38)53(36-18-6-2-7-19-36)37-20-8-3-9-21-37;1-5-16-35(17-6-1)51(36-18-7-2-8-19-36)39-28-29-44-46-31-30-42(45-26-15-27-48(50(45)46)53-49(44)34-39)41-32-33-47(43-25-14-13-24-40(41)43)52(37-20-9-3-10-21-37)38-22-11-4-12-23-38;1-49(2)43-23-13-12-21-38(43)39-27-25-36(31-44(39)49)50(33-15-6-3-7-16-33)37-26-28-40-41-29-30-45(42-22-14-24-46(48(41)42)52-47(40)32-37)51(34-17-8-4-9-18-34)35-19-10-5-11-20-35;1-5-14-29(15-6-1)41(30-16-7-2-8-17-30)33-24-25-34-35-26-27-37(36-22-13-23-38(40(35)36)43-39(34)28-33)42(31-18-9-3-10-19-31)32-20-11-4-12-21-32/h4-42H,1-3H3;3-38H,1-2H3;1-34H;1-34H;3-32H,1-2H3;1-28H
InChIKeyMPOQLMHVMCHTQV-UHFFFAOYSA-N
XLogP91.14
TPSA92.85 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds42
Heavy Atoms336
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004379.61
LogP ≤ 591.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine with MolForge

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Related Compounds

5-N-dibenzofuran-4-yl-16-N-(9,9-dimethylfluoren-2-yl)-16-N-phenyl-5-N-(2-phenylphenyl)-8-oxapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-1(21),2(7),3,5,9,11,13,15,17,19-decaene-5,16-diamine
CID 121295896
4-N-dibenzofuran-4-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-dibenzofuran-4-yl-17-N-phenyl-4-N-(2-phenylphenyl)-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N-naphthalen-2-yl-4-N,17-N-diphenyl-17-N-(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine
CID 159690787
N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)anilino)phenyl]naphthalen-1-yl]-N-phenyldibenzofuran-4-amine
CID 71126683
5-N-dibenzofuran-4-yl-16-N,16-N-diphenyl-5-N-(2-phenylphenyl)-8-thiapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-1(21),2(7),3,5,9,11,13,15,17,19-decaene-5,16-diamine
CID 121296044
4-N,17-N-bis(9,9-dimethylfluoren-2-yl)-4-N,17-N-bis(4-trimethylsilylphenyl)-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine;4-N,17-N-bis(2-phenylphenyl)-4-N,17-N-dipyridin-2-yl-20-oxahexacyclo[11.11.1.02,11.05,10.014,19.021,25]pentacosa-1,3,5,7,9,11,13(25),14(19),15,17,21,23-dodecaene-4,17-diamine
CID 158370013
16-N-dibenzofuran-2-yl-5-N-phenyl-16-N-(2-phenylphenyl)-5-N-(4-trimethylsilylphenyl)-8-thiapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-1(21),2(7),3,5,9,11,13,15,17,19-decaene-5,16-diamine
CID 140711884
N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-4-amine;N-naphthalen-1-yl-N-(4-phenylphenyl)dibenzofuran-4-amine;N-naphthalen-2-yl-N-(4-phenylphenyl)dibenzofuran-4-amine;N-phenyl-N-(3-phenylphenyl)dibenzofuran-4-amine
CID 159844294
12-N-(9,9-dimethylfluoren-2-yl)-5-N,5-N-diphenyl-12-N-(4-phenylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9(17),10,12,14-octaene-5,12-diamine
CID 168855534
N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;7-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;7-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-2-ylnaphthalen-1-yl)-N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)dibenzofuran-4-amine
CID 159210200
5-N-dibenzofuran-4-yl-5-N,14-N,14-N-triphenyl-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine
CID 122473491
20-deuterio-16-N-dibenzofuran-4-yl-5-N,5-N-bis(4-phenylphenyl)-16-N-(4-trimethylsilylphenyl)-8-thiapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-1(21),2(7),3,5,9,11,13,15,17,19-decaene-5,16-diamine
CID 140711822
N-dibenzofuran-4-yl-16-[4-(N-dibenzofuran-4-ylanilino)phenyl]-N-(2-phenylphenyl)-8-oxapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-1(21),2(7),3,5,9,11,13,15,17,19-decaen-5-amine
CID 121295928

Frequently Asked Questions

What is the IUPAC name of 5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine?
The IUPAC name of 5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine (CID 159634634) is 5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine.
What is the SMILES notation for 5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine?
The canonical SMILES for 5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine is CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)Oc3cccc5c(-c6ccc(N(c7ccccc7)c7ccccc7)c7ccccc67)ccc-4c35)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)Sc3cccc5c(N(c6ccccc6)c6ccccc6)ccc-4c35)cc21.C[Si](C)(C)c1ccc(N(c2ccccc2)c2ccc3cc(-c4ccc5c6c(cccc46)Oc4cc(N(c6ccccc6-c6ccccc6)c6cccc7c6oc6ccccc67)ccc4-5)ccc3c2)cc1.c1ccc(-c2ccccc2N(c2ccc3c(c2)Sc2cccc4c(N(c5ccccc5)c5ccccc5)ccc-3c24)c2cccc3c2oc2ccccc23)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)Oc2cccc4c(-c5ccc(N(c6ccccc6)c6ccccc6)c6ccccc56)ccc-3c24)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)Sc2cccc4c(N(c5ccccc5)c5ccccc5)ccc-3c24)cc1.
What is the InChIKey of 5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine?
The InChIKey is MPOQLMHVMCHTQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H48N2O2Si.C59H42N2O.C52H34N2OS.C50H34N2O.C49H36N2S.C40H28N2S/c1-70(2,3)51-35-32-48(33-36-51)66(47-18-8-5-9-19-47)49-31-30-44-40-46(29-28-45(44)41-49)52-38-39-57-55-37-34-50(42-63(55)68-62-27-15-22-56(52)64(57)62)67(59-24-12-10-20-53(59)43-16-6-4-7-17-43)60-25-14-23-58-54-21-11-13-26-61(54)69-65(58)60;1-59(2)53-27-15-14-24-47(53)48-31-29-42(37-54(48)59)60(39-17-6-3-7-18-39)43-30-32-50-52-34-33-46(51-26-16-28-56(58(51)52)62-57(50)38-43)45-35-36-55(49-25-13-12-23-44(45)49)61(40-19-8-4-9-20-40)41-21-10-5-11-22-41;1-4-16-35(17-5-1)39-22-10-12-26-45(39)54(47-27-14-24-43-40-23-11-13-28-48(40)55-52(43)47)38-30-31-41-42-32-33-46(44-25-15-29-49(51(42)44)56-50(41)34-38)53(36-18-6-2-7-19-36)37-20-8-3-9-21-37;1-5-16-35(17-6-1)51(36-18-7-2-8-19-36)39-28-29-44-46-31-30-42(45-26-15-27-48(50(45)46)53-49(44)34-39)41-32-33-47(43-25-14-13-24-40(41)43)52(37-20-9-3-10-21-37)38-22-11-4-12-23-38;1-49(2)43-23-13-12-21-38(43)39-27-25-36(31-44(39)49)50(33-15-6-3-7-16-33)37-26-28-40-41-29-30-45(42-22-14-24-46(48(41)42)52-47(40)32-37)51(34-17-8-4-9-18-34)35-19-10-5-11-20-35;1-5-14-29(15-6-1)41(30-16-7-2-8-17-30)33-24-25-34-35-26-27-37(36-22-13-23-38(40(35)36)43-39(34)28-33)42(31-18-9-3-10-19-31)32-20-11-4-12-21-32/h4-42H,1-3H3;3-38H,1-2H3;1-34H;1-34H;3-32H,1-2H3;1-28H.
What are the key properties of 5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine?
5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine has a molecular weight of 4379.61 g/mol, XLogP of 91.14, 42 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-dibenzofuran-4-yl-14-N,14-N-diphenyl-5-N-(2-phenylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N-dibenzofuran-4-yl-N-(2-phenylphenyl)-14-[6-(N-(4-trimethylsilylphenyl)anilino)naphthalen-2-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N-(9,9-dimethylfluoren-2-yl)-5-N,14-N,14-N-triphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine;N,N-diphenyl-14-[4-(N-phenylanilino)naphthalen-1-yl]-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaen-5-amine;5-N,5-N,14-N,14-N-tetraphenyl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2(7),3,5,9,11,13,15-octaene-5,14-diamine is sourced from PubChem (CID 159634634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).