10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine

C300H212N12O6S2 — CID 158772076

IUPAC10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine
SMILESCc1ccc(-c2ccccc2)cc1N(c1cccc2c1oc1c(C(C)(C)C)cccc12)c1c2ccccc2cc2c1c1cccc3c4c(N(c5cc(-c6ccccc6)ccc5C)c5cccc6c5oc5c(C(C)(C)C)cccc56)c5ccccc5cc4n2c13.Cc1ccc(-c2ccccc2)cc1N(c1cccc2c1oc1ccccc12)c1c2ccccc2cc2c1c1cccc3c4c(N(c5cc(-c6ccccc6)ccc5C)c5cccc6c5oc5c(-c7ccccc7)cccc56)c5ccccc5cc4n2c13.Cc1ccc2c(oc3c(C(C)(C)C)cccc32)c1N(c1ccccc1)c1c2ccccc2cc2c1c1cccc3c4c(N(c5ccccc5)c5c(C)ccc6c5oc5c(C(C)(C)C)cccc56)c5ccccc5cc4n2c13.c1ccc(N(c2ccc3sc4ccccc4c3c2)c2c3ccccc3cc3c2c2cccc4c5c(N(c6ccccc6)c6ccc7sc8ccccc8c7c6)c6ccccc6cc5n3c24)cc1
InChIInChI=1S/C84H65N3O2.C82H53N3O2.C72H57N3O2.C62H37N3S2/c1-50-42-44-54(52-24-11-9-12-25-52)46-70(50)85(68-40-22-34-62-60-32-20-38-66(83(3,4)5)79(60)88-81(62)68)77-58-30-17-15-28-56(58)48-72-74(77)64-36-19-37-65-75-73(87(72)76(64)65)49-57-29-16-18-31-59(57)78(75)86(71-47-55(45-43-51(71)2)53-26-13-10-14-27-53)69-41-23-35-63-61-33-21-39-67(84(6,7)8)80(61)89-82(63)69;1-50-42-44-55(52-22-6-3-7-23-52)46-70(50)83(68-39-20-35-63-62-32-16-17-41-74(62)86-81(63)68)78-59-30-14-12-28-57(59)48-72-75(78)66-37-19-38-67-76-73(85(72)77(66)67)49-58-29-13-15-31-60(58)79(76)84(71-47-56(45-43-51(71)2)53-24-8-4-9-25-53)69-40-21-36-65-64-34-18-33-61(80(64)87-82(65)69)54-26-10-5-11-27-54;1-42-36-38-52-50-30-20-34-56(71(3,4)5)67(50)76-69(52)62(42)73(46-24-11-9-12-25-46)65-48-28-17-15-22-44(48)40-58-60(65)54-32-19-33-55-61-59(75(58)64(54)55)41-45-23-16-18-29-49(45)66(61)74(47-26-13-10-14-27-47)63-43(2)37-39-53-51-31-21-35-57(72(6,7)8)68(51)77-70(53)63;1-3-18-40(19-4-1)63(42-30-32-56-50(36-42)46-24-11-13-28-54(46)66-56)61-44-22-9-7-16-38(44)34-52-58(61)48-26-15-27-49-59-53(65(52)60(48)49)35-39-17-8-10-23-45(39)62(59)64(41-20-5-2-6-21-41)43-31-33-57-51(37-43)47-25-12-14-29-55(47)67-57/h9-49H,1-8H3;3-49H,1-2H3;9-41H,1-8H3;1-37H
InChIKeyIPZNRCBCHSZANQ-UHFFFAOYSA-N
MW4145.21 g/mol
LogP87.84
Rot. Bonds29

About 10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine

10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine (PubChem CID 158772076) has the molecular formula C300H212N12O6S2 and a molecular weight of 4145.21 g/mol. Its IUPAC name is 10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine.

Molecular Properties

Compound Name10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine
PubChem CID158772076
Molecular FormulaC300H212N12O6S2
Molecular Weight4145.21 g/mol
Exact Mass4141.61
IUPAC Name10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine
SMILESCc1ccc(-c2ccccc2)cc1N(c1cccc2c1oc1c(C(C)(C)C)cccc12)c1c2ccccc2cc2c1c1cccc3c4c(N(c5cc(-c6ccccc6)ccc5C)c5cccc6c5oc5c(C(C)(C)C)cccc56)c5ccccc5cc4n2c13.Cc1ccc(-c2ccccc2)cc1N(c1cccc2c1oc1ccccc12)c1c2ccccc2cc2c1c1cccc3c4c(N(c5cc(-c6ccccc6)ccc5C)c5cccc6c5oc5c(-c7ccccc7)cccc56)c5ccccc5cc4n2c13.Cc1ccc2c(oc3c(C(C)(C)C)cccc32)c1N(c1ccccc1)c1c2ccccc2cc2c1c1cccc3c4c(N(c5ccccc5)c5c(C)ccc6c5oc5c(C(C)(C)C)cccc56)c5ccccc5cc4n2c13.c1ccc(N(c2ccc3sc4ccccc4c3c2)c2c3ccccc3cc3c2c2cccc4c5c(N(c6ccccc6)c6ccc7sc8ccccc8c7c6)c6ccccc6cc5n3c24)cc1
InChIInChI=1S/C84H65N3O2.C82H53N3O2.C72H57N3O2.C62H37N3S2/c1-50-42-44-54(52-24-11-9-12-25-52)46-70(50)85(68-40-22-34-62-60-32-20-38-66(83(3,4)5)79(60)88-81(62)68)77-58-30-17-15-28-56(58)48-72-74(77)64-36-19-37-65-75-73(87(72)76(64)65)49-57-29-16-18-31-59(57)78(75)86(71-47-55(45-43-51(71)2)53-26-13-10-14-27-53)69-41-23-35-63-61-33-21-39-67(84(6,7)8)80(61)89-82(63)69;1-50-42-44-55(52-22-6-3-7-23-52)46-70(50)83(68-39-20-35-63-62-32-16-17-41-74(62)86-81(63)68)78-59-30-14-12-28-57(59)48-72-75(78)66-37-19-38-67-76-73(85(72)77(66)67)49-58-29-13-15-31-60(58)79(76)84(71-47-56(45-43-51(71)2)53-24-8-4-9-25-53)69-40-21-36-65-64-34-18-33-61(80(64)87-82(65)69)54-26-10-5-11-27-54;1-42-36-38-52-50-30-20-34-56(71(3,4)5)67(50)76-69(52)62(42)73(46-24-11-9-12-25-46)65-48-28-17-15-22-44(48)40-58-60(65)54-32-19-33-55-61-59(75(58)64(54)55)41-45-23-16-18-29-49(45)66(61)74(47-26-13-10-14-27-47)63-43(2)37-39-53-51-31-21-35-57(72(6,7)8)68(51)77-70(53)63;1-3-18-40(19-4-1)63(42-30-32-56-50(36-42)46-24-11-13-28-54(46)66-56)61-44-22-9-7-16-38(44)34-52-58(61)48-26-15-27-49-59-53(65(52)60(48)49)35-39-17-8-10-23-45(39)62(59)64(41-20-5-2-6-21-41)43-31-33-57-51(37-43)47-25-12-14-29-55(47)67-57/h9-49H,1-8H3;3-49H,1-2H3;9-41H,1-8H3;1-37H
InChIKeyIPZNRCBCHSZANQ-UHFFFAOYSA-N
XLogP87.84
TPSA122.40 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds29
Heavy Atoms320
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004145.21
LogP ≤ 587.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine with MolForge

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Related Compounds

3-methyl-N-[4-[24-[4-(N-(3-methyldibenzofuran-4-yl)anilino)phenyl]-3,18-diphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2,4(17),6(11),7,9,12(32),13,15,18,21(26),22,24,27(31),28-pentadecaen-9-yl]phenyl]-N-phenyldibenzofuran-4-amine;14,24,29-tritert-butyl-N-(6-tert-butyldibenzofuran-4-yl)-N-(2-methyl-5-phenylphenyl)-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2(19),3,6(11),7,9,12(32),13,15,17,21(26),22,24,27(31),28-pentadecaen-8-amine;14,24,29-tritert-butyl-N-(2-methylphenyl)-N-(6-phenyldibenzofuran-4-yl)-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2(19),3,6(11),7,9,12(32),13,15,17,21(26),22,24,27(31),28-pentadecaen-8-amine;14,24,29-tritert-butyl-N-phenyl-N-(3-phenylphenyl)-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2(19),3,6(11),7,9,12(32),13,15,17,21(26),22,24,27(31),28-pentadecaen-8-amine
CID 165076317
6-tert-butyl-N-(4-naphthalen-2-ylphenyl)-N-(4-phenanthren-9-ylphenyl)dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-phenanthren-9-ylphenyl)dibenzofuran-4-amine;N-dibenzothiophen-3-yl-N-(4-phenanthren-9-ylphenyl)dibenzofuran-4-amine;N-(4-naphthalen-2-ylphenyl)-N-(4-phenanthren-9-ylphenyl)-6-phenyldibenzofuran-4-amine
CID 159129251
14,24,29-tritert-butyl-N,N-bis(4-methylphenyl)-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2(19),3,6(11),7,9,12(32),13,15,17,21(26),22,24,27(31),28-pentadecaen-8-amine;14,24,29-tritert-butyl-N-(6-tert-butyl-3-methyldibenzofuran-4-yl)-N-phenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2(19),3,6(11),7,9,12(32),13,15,17,21(26),22,24,27(31),28-pentadecaen-8-amine;14,24,29-tritert-butyl-N-dibenzofuran-4-yl-N-(2-methyl-5-phenylphenyl)-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2(19),3,6(11),7,9,12(32),13,15,17,21(26),22,24,27(31),28-pentadecaen-8-amine
CID 159955184
8-N,23-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-8-N,23-N-diphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2,4(17),6(11),7,9,12(32),13,15,18,21(26),22,24,27(31),28-pentadecaene-8,23-diamine;8-N,23-N-bis[3-methyl-6-(2-methylphenyl)dibenzofuran-4-yl]-8-N,23-N-diphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2,4(17),6(11),7,9,12(32),13,15,18,21(26),22,24,27(31),28-pentadecaene-8,23-diamine;8-N,23-N-bis(3-methyl-6-phenyldibenzofuran-4-yl)-8-N,23-N-diphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2,4(17),6(11),7,9,12(32),13,15,18,21(26),22,24,27(31),28-pentadecaene-8,23-diamine
CID 161147757
5-N,20-N-bis(6-tert-butyldibenzofuran-4-yl)-5-N,20-N-bis(2-methylphenyl)-9,24-diazanonacyclo[15.13.1.12,9.03,8.010,15.018,23.024,31.025,30.016,32]dotriaconta-1(31),2(32),3(8),4,6,10,12,14,16,18(23),19,21,25,27,29-pentadecaene-5,20-diamine;6-N,21-N-bis(2-methylphenyl)-6-N,21-N-diphenyl-9,24-diazanonacyclo[15.13.1.12,9.03,8.010,15.018,23.024,31.025,30.016,32]dotriaconta-1,3(8),4,6,10,12,14,16(32),17(31),18(23),19,21,25,27,29-pentadecaene-6,21-diamine;N-(3-methyldibenzofuran-4-yl)-20-[(3-methyldibenzofuran-4-yl)-(2-methyl-5-phenylphenyl)methyl]-N-(2-methyl-5-phenylphenyl)-9,24-diazanonacyclo[15.13.1.12,9.03,8.010,15.018,23.024,31.025,30.016,32]dotriaconta-1(31),2(32),3(8),4,6,10,12,14,16,18(23),19,21,25,27,29-pentadecaen-5-amine;6-N,6-N,21-N,21-N-tetraphenyl-9,24-diazanonacyclo[15.13.1.12,9.03,8.010,15.018,23.024,31.025,30.016,32]dotriaconta-1,3(8),4,6,10,12,14,16(32),17(31),18(23),19,21,25,27,29-pentadecaene-6,21-diamine
CID 162167747
10-N,25-N-di(dibenzofuran-4-yl)-10-N,25-N-bis(2-methyl-5-phenylphenyl)-3,18-diphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2,4(17),6(11),7,9,12(32),13,15,18,21(26),22,24,27(31),28-pentadecaene-10,25-diamine;3-methyl-N-[4-[25-[4-(N-(3-methyldibenzofuran-4-yl)anilino)phenyl]-3,18-diphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2,4(17),6,8,10,12(32),13,15,18,21,23,25,27(31),28-pentadecaen-10-yl]phenyl]-N-phenyldibenzofuran-4-amine
CID 158806311
1-N,6-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-1-N,6-N-diphenylpyrene-1,6-diamine;1-N,6-N-bis(6-cyclohexyldibenzofuran-4-yl)-1-N,6-N-diphenylpyrene-1,6-diamine;1-N,6-N-bis(3-methyldibenzofuran-4-yl)-1-N,6-N-bis(2-methyl-5-phenylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(3-methyldibenzofuran-4-yl)-1-N,6-N-diphenylpyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-methylphenyl)pyrene-1,6-diamine;1-N,6-N-diphenyl-1-N,6-N-bis(6-phenyldibenzofuran-4-yl)pyrene-1,6-diamine
CID 158236047
1-N,6-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine;6-N-dibenzofuran-4-yl-1-N-(3-methyldibenzofuran-4-yl)-1-N,6-N-bis(2-methyl-5-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-di(dibenzofuran-4-yl)-1-N,6-N-bis(2-methylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine
CID 161114249
10-N,25-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2,4(17),6(11),7,9,12(32),13,15,18,21(26),22,24,27(31),28-pentadecaene-10,25-diamine;10-N,25-N-bis(3-methyldibenzofuran-4-yl)-3,18-diphenyl-10-N,25-N-bis(2-phenylphenyl)-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2,4(17),6(11),7,9,12(32),13,15,18,21(26),22,24,27(31),28-pentadecaene-10,25-diamine;10-N,25-N-bis[3-methyl-6-(2-methylphenyl)dibenzofuran-4-yl]-10-N,25-N,3,18-tetraphenyl-5,20-diazanonacyclo[18.10.1.15,12.02,19.04,17.06,11.021,26.027,31.016,32]dotriaconta-1(30),2,4(17),6(11),7,9,12(32),13,15,18,21(26),22,24,27(31),28-pentadecaene-10,25-diamine;methane
CID 163756535
N-dibenzothiophen-2-yl-6-phenyl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine
CID 167396326
1-N,6-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-bis(3-methyldibenzofuran-4-yl)-1-N,6-N-bis(2-methylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-bis(3-methyldibenzofuran-4-yl)-1-N,6-N-bis(2-methyl-5-phenylphenyl)-3,8-di(propan-2-yl)pyrene-1,6-diamine;1-N,6-N-bis(3-methyldibenzofuran-4-yl)-1-N,6-N-diphenyl-3,8-di(propan-2-yl)pyrene-1,6-diamine
CID 163594288
N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine
CID 163977940

Frequently Asked Questions

What is the IUPAC name of 10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine?
The IUPAC name of 10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine (CID 158772076) is 10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine.
What is the SMILES notation for 10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine?
The canonical SMILES for 10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine is Cc1ccc(-c2ccccc2)cc1N(c1cccc2c1oc1c(C(C)(C)C)cccc12)c1c2ccccc2cc2c1c1cccc3c4c(N(c5cc(-c6ccccc6)ccc5C)c5cccc6c5oc5c(C(C)(C)C)cccc56)c5ccccc5cc4n2c13.Cc1ccc(-c2ccccc2)cc1N(c1cccc2c1oc1ccccc12)c1c2ccccc2cc2c1c1cccc3c4c(N(c5cc(-c6ccccc6)ccc5C)c5cccc6c5oc5c(-c7ccccc7)cccc56)c5ccccc5cc4n2c13.Cc1ccc2c(oc3c(C(C)(C)C)cccc32)c1N(c1ccccc1)c1c2ccccc2cc2c1c1cccc3c4c(N(c5ccccc5)c5c(C)ccc6c5oc5c(C(C)(C)C)cccc56)c5ccccc5cc4n2c13.c1ccc(N(c2ccc3sc4ccccc4c3c2)c2c3ccccc3cc3c2c2cccc4c5c(N(c6ccccc6)c6ccc7sc8ccccc8c7c6)c6ccccc6cc5n3c24)cc1.
What is the InChIKey of 10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine?
The InChIKey is IPZNRCBCHSZANQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H65N3O2.C82H53N3O2.C72H57N3O2.C62H37N3S2/c1-50-42-44-54(52-24-11-9-12-25-52)46-70(50)85(68-40-22-34-62-60-32-20-38-66(83(3,4)5)79(60)88-81(62)68)77-58-30-17-15-28-56(58)48-72-74(77)64-36-19-37-65-75-73(87(72)76(64)65)49-57-29-16-18-31-59(57)78(75)86(71-47-55(45-43-51(71)2)53-26-13-10-14-27-53)69-41-23-35-63-61-33-21-39-67(84(6,7)8)80(61)89-82(63)69;1-50-42-44-55(52-22-6-3-7-23-52)46-70(50)83(68-39-20-35-63-62-32-16-17-41-74(62)86-81(63)68)78-59-30-14-12-28-57(59)48-72-75(78)66-37-19-38-67-76-73(85(72)77(66)67)49-58-29-13-15-31-60(58)79(76)84(71-47-56(45-43-51(71)2)53-24-8-4-9-25-53)69-40-21-36-65-64-34-18-33-61(80(64)87-82(65)69)54-26-10-5-11-27-54;1-42-36-38-52-50-30-20-34-56(71(3,4)5)67(50)76-69(52)62(42)73(46-24-11-9-12-25-46)65-48-28-17-15-22-44(48)40-58-60(65)54-32-19-33-55-61-59(75(58)64(54)55)41-45-23-16-18-29-49(45)66(61)74(47-26-13-10-14-27-47)63-43(2)37-39-53-51-31-21-35-57(72(6,7)8)68(51)77-70(53)63;1-3-18-40(19-4-1)63(42-30-32-56-50(36-42)46-24-11-13-28-54(46)66-56)61-44-22-9-7-16-38(44)34-52-58(61)48-26-15-27-49-59-53(65(52)60(48)49)35-39-17-8-10-23-45(39)62(59)64(41-20-5-2-6-21-41)43-31-33-57-51(37-43)47-25-12-14-29-55(47)67-57/h9-49H,1-8H3;3-49H,1-2H3;9-41H,1-8H3;1-37H.
What are the key properties of 10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine?
10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine has a molecular weight of 4145.21 g/mol, XLogP of 87.84, 29 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 10-N,18-N-bis(6-tert-butyldibenzofuran-4-yl)-10-N,18-N-bis(2-methyl-5-phenylphenyl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-bis(6-tert-butyl-3-methyldibenzofuran-4-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N-dibenzofuran-4-yl-10-N,18-N-bis(2-methyl-5-phenylphenyl)-18-N-(6-phenyldibenzofuran-4-yl)-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine;10-N,18-N-di(dibenzothiophen-2-yl)-10-N,18-N-diphenyl-1-azaheptacyclo[14.10.1.02,11.04,9.012,27.017,26.019,24]heptacosa-2,4,6,8,10,12(27),13,15,17,19,21,23,25-tridecaene-10,18-diamine is sourced from PubChem (CID 158772076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).