About N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)aniline;N-naphthalen-1-yl-7-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]dibenzofuran-3-amine;N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N-[3-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)pyridin-4-amine;4-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)aniline;N-naphthalen-1-yl-7-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]dibenzofuran-3-amine;N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N-[3-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)pyridin-4-amine;4-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline (PubChem CID 162039513) has the molecular formula C359H237N13O2
and a molecular weight of 4764.93 g/mol. Its IUPAC name is N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)aniline;N-naphthalen-1-yl-7-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]dibenzofuran-3-amine;N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N-[3-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)pyridin-4-amine;4-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline.
Frequently Asked Questions
What is the IUPAC name of N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)aniline;N-naphthalen-1-yl-7-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]dibenzofuran-3-amine;N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N-[3-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)pyridin-4-amine;4-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline?
The IUPAC name of N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)aniline;N-naphthalen-1-yl-7-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]dibenzofuran-3-amine;N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N-[3-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)pyridin-4-amine;4-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline (CID 162039513) is N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)aniline;N-naphthalen-1-yl-7-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]dibenzofuran-3-amine;N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N-[3-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)pyridin-4-amine;4-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline.
What is the SMILES notation for N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)aniline;N-naphthalen-1-yl-7-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]dibenzofuran-3-amine;N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N-[3-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)pyridin-4-amine;4-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline?
The canonical SMILES for N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)aniline;N-naphthalen-1-yl-7-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]dibenzofuran-3-amine;N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N-[3-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)pyridin-4-amine;4-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline is c1ccc(-c2c3ccccc3n3c4ccccc4c4cc(-c5ccc(N(c6ccc(-c7cccc8ccccc78)cc6)c6ccc(-c7cccc8ccccc78)cc6)cc5)ccc4c23)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6c(c5)c5ccccc5n5c7ccccc7c(-c7ccccc7)c65)cc4)c4ccc5c(c4)oc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-c5ccc6c(c5)c5ccccc5n5c7ccccc7c(-c7ccccc7)c65)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)c4ccccc4n4c6ccccc6c(-c6ccccc6)c54)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccncc3)c3cccc(-c4ccc(-c5ccc6c(c5)c5ccccc5n5c7ccccc7c(-c7ccccc7)c65)cc4)c3)cc2)cc1.c1ccc(-c2ccc3c(c2)oc2cc(N(c4ccc(-c5ccc6c(c5)c5ccccc5n5c7ccccc7c(-c7ccccc7)c65)cc4)c4cccc5ccccc45)ccc23)cc1.
What is the InChIKey of N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)aniline;N-naphthalen-1-yl-7-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]dibenzofuran-3-amine;N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N-[3-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)pyridin-4-amine;4-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline?
The InChIKey is YXBXZEBUXUOPBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H42N2.C62H40N2O.C62H42N2.C60H38N2O.C56H38N2.C55H37N3/c1-2-16-48(17-3-1)63-59-23-9-11-27-62(59)66-61-26-10-8-22-57(61)60-42-49(34-41-58(60)64(63)66)43-28-35-50(36-29-43)65(51-37-30-46(31-38-51)55-24-12-18-44-14-4-6-20-53(44)55)52-39-32-47(33-40-52)56-25-13-19-45-15-5-7-21-54(45)56;1-3-13-41(14-4-1)42-23-25-43(26-24-42)44-27-32-48(33-28-44)63(50-36-38-53-52-18-9-12-22-59(52)65-60(53)40-50)49-34-29-45(30-35-49)47-31-37-54-56(39-47)51-17-7-10-20-57(51)64-58-21-11-8-19-55(58)61(62(54)64)46-15-5-2-6-16-46;1-4-14-43(15-5-1)46-28-35-52(36-29-46)63(53-37-30-47(31-38-53)44-16-6-2-7-17-44)54-39-32-48(33-40-54)45-24-26-49(27-25-45)51-34-41-56-58(42-51)55-20-10-12-22-59(55)64-60-23-13-11-21-57(60)61(62(56)64)50-18-8-3-9-19-50;1-3-14-39(15-4-1)44-28-33-49-50-35-32-46(38-58(50)63-57(49)37-44)61(54-25-13-19-41-16-7-8-20-47(41)54)45-30-26-40(27-31-45)43-29-34-51-53(36-43)48-21-9-11-23-55(48)62-56-24-12-10-22-52(56)59(60(51)62)42-17-5-2-6-18-42;1-4-14-39(15-5-1)41-24-31-46(32-25-41)57(47-33-26-42(27-34-47)40-16-6-2-7-17-40)48-35-28-43(29-36-48)45-30-37-50-52(38-45)49-20-10-12-22-53(49)58-54-23-13-11-21-51(54)55(56(50)58)44-18-8-3-9-19-44;1-3-12-38(13-4-1)39-26-29-45(30-27-39)57(46-32-34-56-35-33-46)47-17-11-16-43(36-47)40-22-24-41(25-23-40)44-28-31-49-51(37-44)48-18-7-9-20-52(48)58-53-21-10-8-19-50(53)54(55(49)58)42-14-5-2-6-15-42/h1-42H;1-40H;1-42H;1-38H;1-38H;1-37H.
What are the key properties of N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)aniline;N-naphthalen-1-yl-7-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]dibenzofuran-3-amine;N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N-[3-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)pyridin-4-amine;4-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline?
N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)aniline;N-naphthalen-1-yl-7-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]dibenzofuran-3-amine;N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N-[3-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)pyridin-4-amine;4-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline has a molecular weight of 4764.93 g/mol, XLogP of 99.87, 42 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-naphthalen-1-ylphenyl)-4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)aniline;N-naphthalen-1-yl-7-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]dibenzofuran-3-amine;N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N-[3-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)pyridin-4-amine;4-phenyl-N-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(21-phenyl-14-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-5-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 162039513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).