2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole

C274H248N32O4S7 — CID 159692365

IUPAC2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole
SMILESCC(C)C1=Nc2c(c3ccc(-c4ccc5c(c4)CCc4[nH]c(C(C)C)nc4-5)cc3c3sccc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5c(c4)OCc4[nH]c(C(C)C)nc4-5)cc3c3cncnc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5c(c4)OCc4[nH]c(C(C)C)nc4-5)cc3c3nccnc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5c(c4)OCc4[nH]c(C(C)C)nc4-5)cc3c3sccc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5c(ccc6[nH]c(C(C)C)nc65)c4)cc3c3sccc23)C1.CC(C)C1=Nc2cc3sc4cc(-c5ccc6c(c5)CCc5[nH]c(C(C)C)nc5-6)ccc4c3cc2C1.CC(C)C1=Nc2cc3sc4cc(-c5ccc6c(c5)OCc5[nH]c(C(C)C)nc5-6)ccc4c3cc2C1.CC(C)C1=Nc2cc3sc4cc(-c5ccc6c(ccc7[nH]c(C(C)C)nc76)c5)ccc4c3cc2C1.CC(C)c1nc2c([nH]1)CCc1cc(-c3ccc4c(c3)sc3c4ccc4[nH]c(C(C)C)nc43)ccc1-2
InChIInChI=1S/C31H29N3S.C31H27N3S.C31H29N3S.C31H27N3S.2C30H27N5O.C30H28N4S.2C30H27N3OS/c2*1-16(2)26-13-21-12-24-23-9-6-19(14-28(23)35-29(24)15-27(21)32-26)18-5-8-22-20(11-18)7-10-25-30(22)34-31(33-25)17(3)4;2*1-16(2)27-15-24-22-9-6-19(14-25(22)30-23(11-12-35-30)28(24)32-27)18-5-8-21-20(13-18)7-10-26-29(21)34-31(33-26)17(3)4;1-15(2)24-11-22-19-7-5-17(9-21(19)23-12-31-14-32-28(23)29(22)33-24)18-6-8-20-26(10-18)36-13-25-27(20)35-30(34-25)16(3)4;1-15(2)23-13-22-19-7-5-17(11-21(19)27-29(28(22)33-23)32-10-9-31-27)18-6-8-20-25(12-18)36-14-24-26(20)35-30(34-24)16(3)4;1-15(2)29-31-23-11-7-19-13-17(5-8-20(19)26(23)33-29)18-6-9-21-22-10-12-24-27(28(22)35-25(21)14-18)34-30(32-24)16(3)4;1-15(2)23-10-19-9-22-20-7-5-18(12-27(20)35-28(22)13-24(19)31-23)17-6-8-21-26(11-17)34-14-25-29(21)33-30(32-25)16(3)4;1-15(2)24-13-22-19-7-5-17(11-23(19)29-21(9-10-35-29)27(22)31-24)18-6-8-20-26(12-18)34-14-25-28(20)33-30(32-25)16(3)4/h5-6,8-9,11-12,14-17H,7,10,13H2,1-4H3,(H,33,34);5-12,14-17H,13H2,1-4H3,(H,33,34);5-6,8-9,11-14,16-17H,7,10,15H2,1-4H3,(H,33,34);5-14,16-17H,15H2,1-4H3,(H,33,34);5-10,12,14-16H,11,13H2,1-4H3,(H,34,35);5-12,15-16H,13-14H2,1-4H3,(H,34,35);5-6,8-10,12-16H,7,11H2,1-4H3,(H,31,33)(H,32,34);5-9,11-13,15-16H,10,14H2,1-4H3,(H,32,33);5-12,15-16H,13-14H2,1-4H3,(H,32,33)
InChIKeyMWOQXKZZAQFOAL-UHFFFAOYSA-N
MW4277.69 g/mol
LogP74.99
Rot. Bonds27

About 2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole

2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole (PubChem CID 159692365) has the molecular formula C274H248N32O4S7 and a molecular weight of 4277.69 g/mol. Its IUPAC name is 2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole.

Molecular Properties

Compound Name2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole
PubChem CID159692365
Molecular FormulaC274H248N32O4S7
Molecular Weight4277.69 g/mol
Exact Mass4273.82
IUPAC Name2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole
SMILESCC(C)C1=Nc2c(c3ccc(-c4ccc5c(c4)CCc4[nH]c(C(C)C)nc4-5)cc3c3sccc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5c(c4)OCc4[nH]c(C(C)C)nc4-5)cc3c3cncnc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5c(c4)OCc4[nH]c(C(C)C)nc4-5)cc3c3nccnc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5c(c4)OCc4[nH]c(C(C)C)nc4-5)cc3c3sccc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5c(ccc6[nH]c(C(C)C)nc65)c4)cc3c3sccc23)C1.CC(C)C1=Nc2cc3sc4cc(-c5ccc6c(c5)CCc5[nH]c(C(C)C)nc5-6)ccc4c3cc2C1.CC(C)C1=Nc2cc3sc4cc(-c5ccc6c(c5)OCc5[nH]c(C(C)C)nc5-6)ccc4c3cc2C1.CC(C)C1=Nc2cc3sc4cc(-c5ccc6c(ccc7[nH]c(C(C)C)nc76)c5)ccc4c3cc2C1.CC(C)c1nc2c([nH]1)CCc1cc(-c3ccc4c(c3)sc3c4ccc4[nH]c(C(C)C)nc43)ccc1-2
InChIInChI=1S/C31H29N3S.C31H27N3S.C31H29N3S.C31H27N3S.2C30H27N5O.C30H28N4S.2C30H27N3OS/c2*1-16(2)26-13-21-12-24-23-9-6-19(14-28(23)35-29(24)15-27(21)32-26)18-5-8-22-20(11-18)7-10-25-30(22)34-31(33-25)17(3)4;2*1-16(2)27-15-24-22-9-6-19(14-25(22)30-23(11-12-35-30)28(24)32-27)18-5-8-21-20(13-18)7-10-26-29(21)34-31(33-26)17(3)4;1-15(2)24-11-22-19-7-5-17(9-21(19)23-12-31-14-32-28(23)29(22)33-24)18-6-8-20-26(10-18)36-13-25-27(20)35-30(34-25)16(3)4;1-15(2)23-13-22-19-7-5-17(11-21(19)27-29(28(22)33-23)32-10-9-31-27)18-6-8-20-25(12-18)36-14-24-26(20)35-30(34-24)16(3)4;1-15(2)29-31-23-11-7-19-13-17(5-8-20(19)26(23)33-29)18-6-9-21-22-10-12-24-27(28(22)35-25(21)14-18)34-30(32-24)16(3)4;1-15(2)23-10-19-9-22-20-7-5-18(12-27(20)35-28(22)13-24(19)31-23)17-6-8-21-26(11-17)34-14-25-29(21)33-30(32-25)16(3)4;1-15(2)24-13-22-19-7-5-17(11-23(19)29-21(9-10-35-29)27(22)31-24)18-6-8-20-26(12-18)34-14-25-28(20)33-30(32-25)16(3)4/h5-6,8-9,11-12,14-17H,7,10,13H2,1-4H3,(H,33,34);5-12,14-17H,13H2,1-4H3,(H,33,34);5-6,8-9,11-14,16-17H,7,10,15H2,1-4H3,(H,33,34);5-14,16-17H,15H2,1-4H3,(H,33,34);5-10,12,14-16H,11,13H2,1-4H3,(H,34,35);5-12,15-16H,13-14H2,1-4H3,(H,34,35);5-6,8-10,12-16H,7,11H2,1-4H3,(H,31,33)(H,32,34);5-9,11-13,15-16H,10,14H2,1-4H3,(H,32,33);5-12,15-16H,13-14H2,1-4H3,(H,32,33)
InChIKeyMWOQXKZZAQFOAL-UHFFFAOYSA-N
XLogP74.99
TPSA474.16 Ų
H-Bond Donors10
H-Bond Acceptors33
Rotatable Bonds27
Heavy Atoms317
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004277.69
LogP ≤ 574.99
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1033

Analyze 2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole with MolForge

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What is the IUPAC name of 2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole?
The IUPAC name of 2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole (CID 159692365) is 2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole.
What is the SMILES notation for 2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole?
The canonical SMILES for 2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole is CC(C)C1=Nc2c(c3ccc(-c4ccc5c(c4)CCc4[nH]c(C(C)C)nc4-5)cc3c3sccc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5c(c4)OCc4[nH]c(C(C)C)nc4-5)cc3c3cncnc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5c(c4)OCc4[nH]c(C(C)C)nc4-5)cc3c3nccnc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5c(c4)OCc4[nH]c(C(C)C)nc4-5)cc3c3sccc23)C1.CC(C)C1=Nc2c(c3ccc(-c4ccc5c(ccc6[nH]c(C(C)C)nc65)c4)cc3c3sccc23)C1.CC(C)C1=Nc2cc3sc4cc(-c5ccc6c(c5)CCc5[nH]c(C(C)C)nc5-6)ccc4c3cc2C1.CC(C)C1=Nc2cc3sc4cc(-c5ccc6c(c5)OCc5[nH]c(C(C)C)nc5-6)ccc4c3cc2C1.CC(C)C1=Nc2cc3sc4cc(-c5ccc6c(ccc7[nH]c(C(C)C)nc76)c5)ccc4c3cc2C1.CC(C)c1nc2c([nH]1)CCc1cc(-c3ccc4c(c3)sc3c4ccc4[nH]c(C(C)C)nc43)ccc1-2.
What is the InChIKey of 2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole?
The InChIKey is MWOQXKZZAQFOAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H29N3S.C31H27N3S.C31H29N3S.C31H27N3S.2C30H27N5O.C30H28N4S.2C30H27N3OS/c2*1-16(2)26-13-21-12-24-23-9-6-19(14-28(23)35-29(24)15-27(21)32-26)18-5-8-22-20(11-18)7-10-25-30(22)34-31(33-25)17(3)4;2*1-16(2)27-15-24-22-9-6-19(14-25(22)30-23(11-12-35-30)28(24)32-27)18-5-8-21-20(13-18)7-10-26-29(21)34-31(33-26)17(3)4;1-15(2)24-11-22-19-7-5-17(9-21(19)23-12-31-14-32-28(23)29(22)33-24)18-6-8-20-26(10-18)36-13-25-27(20)35-30(34-25)16(3)4;1-15(2)23-13-22-19-7-5-17(11-21(19)27-29(28(22)33-23)32-10-9-31-27)18-6-8-20-25(12-18)36-14-24-26(20)35-30(34-24)16(3)4;1-15(2)29-31-23-11-7-19-13-17(5-8-20(19)26(23)33-29)18-6-9-21-22-10-12-24-27(28(22)35-25(21)14-18)34-30(32-24)16(3)4;1-15(2)23-10-19-9-22-20-7-5-18(12-27(20)35-28(22)13-24(19)31-23)17-6-8-21-26(11-17)34-14-25-29(21)33-30(32-25)16(3)4;1-15(2)24-13-22-19-7-5-17(11-23(19)29-21(9-10-35-29)27(22)31-24)18-6-8-20-26(12-18)34-14-25-28(20)33-30(32-25)16(3)4/h5-6,8-9,11-12,14-17H,7,10,13H2,1-4H3,(H,33,34);5-12,14-17H,13H2,1-4H3,(H,33,34);5-6,8-9,11-14,16-17H,7,10,15H2,1-4H3,(H,33,34);5-14,16-17H,15H2,1-4H3,(H,33,34);5-10,12,14-16H,11,13H2,1-4H3,(H,34,35);5-12,15-16H,13-14H2,1-4H3,(H,34,35);5-6,8-10,12-16H,7,11H2,1-4H3,(H,31,33)(H,32,34);5-9,11-13,15-16H,10,14H2,1-4H3,(H,32,33);5-12,15-16H,13-14H2,1-4H3,(H,32,33).
What are the key properties of 2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole?
2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole has a molecular weight of 4277.69 g/mol, XLogP of 74.99, 27 rotatable bonds, 10 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-7-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(2-propan-2-yl-3H-[1]benzothiolo[3,2-f]indol-7-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-8-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[2,3-e]benzimidazole;2-propan-2-yl-7-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3H-[1]benzothiolo[3,2-f]indole;9-propan-2-yl-15-(2-propan-2-yl-4,5-dihydro-3H-benzo[e]benzimidazol-7-yl)-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaene;2-propan-2-yl-7-(9-propan-2-yl-3-thia-8-azatetracyclo[10.4.0.02,6.07,11]hexadeca-1(12),2(6),4,7(11),8,13,15-heptaen-15-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,14,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole;2-propan-2-yl-7-(4-propan-2-yl-3,15,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),2(6),3,7(12),8,10,13,15-octaen-10-yl)-3,4-dihydrochromeno[3,4-d]imidazole is sourced from PubChem (CID 159692365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).