About 4-[9,9-dimethyl-7-(1-methyl-2-phenylbenzimidazol-5-yl)fluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-(1,2-diphenylbenzimidazol-5-yl)-9,15-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;4-[4-(1,2-diphenylbenzimidazol-5-yl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-[7-(5-fluoro-1-phenylbenzimidazol-2-yl)-9,9-dimethylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-4,9-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;15-phenyl-4,9-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene
4-[9,9-dimethyl-7-(1-methyl-2-phenylbenzimidazol-5-yl)fluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-(1,2-diphenylbenzimidazol-5-yl)-9,15-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;4-[4-(1,2-diphenylbenzimidazol-5-yl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-[7-(5-fluoro-1-phenylbenzimidazol-2-yl)-9,9-dimethylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-4,9-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;15-phenyl-4,9-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene (PubChem CID 159545201) has the molecular formula C303H199FN22
and a molecular weight of 4167.08 g/mol. Its IUPAC name is 4-[9,9-dimethyl-7-(1-methyl-2-phenylbenzimidazol-5-yl)fluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-(1,2-diphenylbenzimidazol-5-yl)-9,15-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;4-[4-(1,2-diphenylbenzimidazol-5-yl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-[7-(5-fluoro-1-phenylbenzimidazol-2-yl)-9,9-dimethylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-4,9-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;15-phenyl-4,9-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene.
Frequently Asked Questions
What is the IUPAC name of 4-[9,9-dimethyl-7-(1-methyl-2-phenylbenzimidazol-5-yl)fluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-(1,2-diphenylbenzimidazol-5-yl)-9,15-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;4-[4-(1,2-diphenylbenzimidazol-5-yl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-[7-(5-fluoro-1-phenylbenzimidazol-2-yl)-9,9-dimethylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-4,9-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;15-phenyl-4,9-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene?
The IUPAC name of 4-[9,9-dimethyl-7-(1-methyl-2-phenylbenzimidazol-5-yl)fluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-(1,2-diphenylbenzimidazol-5-yl)-9,15-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;4-[4-(1,2-diphenylbenzimidazol-5-yl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-[7-(5-fluoro-1-phenylbenzimidazol-2-yl)-9,9-dimethylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-4,9-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;15-phenyl-4,9-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene (CID 159545201) is 4-[9,9-dimethyl-7-(1-methyl-2-phenylbenzimidazol-5-yl)fluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-(1,2-diphenylbenzimidazol-5-yl)-9,15-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;4-[4-(1,2-diphenylbenzimidazol-5-yl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-[7-(5-fluoro-1-phenylbenzimidazol-2-yl)-9,9-dimethylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-4,9-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;15-phenyl-4,9-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene.
What is the SMILES notation for 4-[9,9-dimethyl-7-(1-methyl-2-phenylbenzimidazol-5-yl)fluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-(1,2-diphenylbenzimidazol-5-yl)-9,15-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;4-[4-(1,2-diphenylbenzimidazol-5-yl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-[7-(5-fluoro-1-phenylbenzimidazol-2-yl)-9,9-dimethylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-4,9-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;15-phenyl-4,9-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene?
The canonical SMILES for 4-[9,9-dimethyl-7-(1-methyl-2-phenylbenzimidazol-5-yl)fluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-(1,2-diphenylbenzimidazol-5-yl)-9,15-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;4-[4-(1,2-diphenylbenzimidazol-5-yl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-[7-(5-fluoro-1-phenylbenzimidazol-2-yl)-9,9-dimethylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-4,9-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;15-phenyl-4,9-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene is CC1(C)c2cc(-c3ccc4c5c3ccc3cccc(c35)n4-c3ccccc3)ccc2-c2ccc(-c3nc4cc(F)ccc4n3-c3ccccc3)cc21.Cn1c(-c2ccccc2)nc2cc(-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc6c7c5ccc5cccc(c57)n6-c5ccccc5)ccc3-4)ccc21.c1ccc(-c2ccc3c4c2ccc2c(-c5ccc6c(c5)nc(-c5ccccc5)n6-c5ccccc5)ccc(c24)n3-c2ccccc2)cc1.c1ccc(-c2nc3cc(-c4ccc(-c5ccc6c7c5ccc5cccc(c57)n6-c5ccccc5)cc4)ccc3n2-c2ccccc2)cc1.c1ccc(-n2c(-c3ccc(-c4ccc5c6c4ccc4c(-c7ccc(-c8nc9ccccc9n8-c8ccccc8)cc7)ccc(c46)n5-c4ccccc4)cc3)nc3ccccc32)cc1.c1ccc(-n2c(-c3cccc(-c4ccc5c6c4ccc4c(-c7cccc(-c8nc9ccccc9n8-c8ccccc8)c7)ccc(c46)n5-c4ccccc4)c3)nc3ccccc32)cc1.
What is the InChIKey of 4-[9,9-dimethyl-7-(1-methyl-2-phenylbenzimidazol-5-yl)fluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-(1,2-diphenylbenzimidazol-5-yl)-9,15-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;4-[4-(1,2-diphenylbenzimidazol-5-yl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-[7-(5-fluoro-1-phenylbenzimidazol-2-yl)-9,9-dimethylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-4,9-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;15-phenyl-4,9-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene?
The InChIKey is MESGCAFQKMLLRV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C58H37N5.C49H35N3.C48H32FN3.2C45H29N3/c1-4-20-42(21-5-1)61-53-34-32-45(38-16-14-18-40(36-38)57-59-49-26-10-12-28-51(49)62(57)43-22-6-2-7-23-43)47-30-31-48-46(33-35-54(61)56(48)55(47)53)39-17-15-19-41(37-39)58-60-50-27-11-13-29-52(50)63(58)44-24-8-3-9-25-44;1-4-14-42(15-5-1)61-53-36-34-45(38-24-28-40(29-25-38)57-59-49-20-10-12-22-51(49)62(57)43-16-6-2-7-17-43)47-32-33-48-46(35-37-54(61)56(48)55(47)53)39-26-30-41(31-27-39)58-60-50-21-11-13-23-52(50)63(58)44-18-8-3-9-19-44;1-49(2)40-27-32(33-20-25-43-42(29-33)50-48(51(43)3)31-11-6-4-7-12-31)18-21-37(40)38-22-19-34(28-41(38)49)36-24-26-45-47-39(36)23-17-30-13-10-16-44(46(30)47)52(45)35-14-8-5-9-15-35;1-48(2)39-26-30(35-23-25-44-46-38(35)22-16-29-10-9-15-43(45(29)46)51(44)33-11-5-3-6-12-33)17-20-36(39)37-21-18-31(27-40(37)48)47-50-41-28-32(49)19-24-42(41)52(47)34-13-7-4-8-14-34;1-5-13-30(14-6-1)35-24-27-41-43-37(35)22-23-38-36(25-28-42(44(38)43)47(41)33-17-9-3-10-18-33)32-21-26-40-39(29-32)46-45(31-15-7-2-8-16-31)48(40)34-19-11-4-12-20-34;1-4-11-33(12-5-1)45-46-39-29-34(24-27-40(39)48(45)36-16-8-3-9-17-36)30-19-21-31(22-20-30)37-26-28-42-44-38(37)25-23-32-13-10-18-41(43(32)44)47(42)35-14-6-2-7-15-35/h2*1-37H;4-29H,1-3H3;3-28H,1-2H3;2*1-29H.
What are the key properties of 4-[9,9-dimethyl-7-(1-methyl-2-phenylbenzimidazol-5-yl)fluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-(1,2-diphenylbenzimidazol-5-yl)-9,15-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;4-[4-(1,2-diphenylbenzimidazol-5-yl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-[7-(5-fluoro-1-phenylbenzimidazol-2-yl)-9,9-dimethylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-4,9-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;15-phenyl-4,9-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene?
4-[9,9-dimethyl-7-(1-methyl-2-phenylbenzimidazol-5-yl)fluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-(1,2-diphenylbenzimidazol-5-yl)-9,15-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;4-[4-(1,2-diphenylbenzimidazol-5-yl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-[7-(5-fluoro-1-phenylbenzimidazol-2-yl)-9,9-dimethylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-4,9-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;15-phenyl-4,9-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene has a molecular weight of 4167.08 g/mol, XLogP of 77.93, 32 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[9,9-dimethyl-7-(1-methyl-2-phenylbenzimidazol-5-yl)fluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-(1,2-diphenylbenzimidazol-5-yl)-9,15-diphenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;4-[4-(1,2-diphenylbenzimidazol-5-yl)phenyl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;4-[7-(5-fluoro-1-phenylbenzimidazol-2-yl)-9,9-dimethylfluoren-2-yl]-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaene;15-phenyl-4,9-bis[3-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene;15-phenyl-4,9-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene is sourced from PubChem (CID 159545201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).