4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline

C252H200ClN55O4 — CID 161185889

IUPAC4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline
SMILESCC(CO)CNCc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.CN(C)Cc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.CNCc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.Cc1c(CO)cncc1-c1ccc2[nH]nc(-c3nc4ccccc4[nH]3)c2c1.Clc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.OCCc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.OCc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.c1ccc2c(-c3ccc4[nH]nc(-c5nc6c(CCN7CCCC7)cccc6[nH]5)c4c3)cncc2c1.c1ccc2c(-c3ccc4[nH]nc(-c5nc6c(CN7CCCC7)cccc6[nH]5)c4c3)cncc2c1.c1ccc2c(-c3ccc4[nH]nc(-c5nc6ccccc6[nH]5)c4c3)cncc2c1
InChIInChI=1S/C29H26N6.C28H26N6O.C28H24N6.C26H22N6.C25H20N6.C25H19N5O.C24H17N5O.C23H14ClN5.C23H15N5.C21H17N5O/c1-2-8-22-21(6-1)17-30-18-24(22)20-10-11-25-23(16-20)28(34-33-25)29-31-26-9-5-7-19(27(26)32-29)12-15-35-13-3-4-14-35;1-17(16-35)12-29-14-20-6-4-8-25-26(20)32-28(31-25)27-22-11-18(9-10-24(22)33-34-27)23-15-30-13-19-5-2-3-7-21(19)23;1-2-8-21-19(6-1)15-29-16-23(21)18-10-11-24-22(14-18)27(33-32-24)28-30-25-9-5-7-20(26(25)31-28)17-34-12-3-4-13-34;1-32(2)15-18-7-5-9-23-24(18)29-26(28-23)25-20-12-16(10-11-22(20)30-31-25)21-14-27-13-17-6-3-4-8-19(17)21;1-26-12-17-6-4-8-22-23(17)29-25(28-22)24-19-11-15(9-10-21(19)30-31-24)20-14-27-13-16-5-2-3-7-18(16)20;31-11-10-15-5-3-7-22-23(15)28-25(27-22)24-19-12-16(8-9-21(19)29-30-24)20-14-26-13-17-4-1-2-6-18(17)20;30-13-16-5-3-7-21-22(16)27-24(26-21)23-18-10-14(8-9-20(18)28-29-23)19-12-25-11-15-4-1-2-6-17(15)19;24-18-6-3-7-20-22(18)27-23(26-20)21-16-10-13(8-9-19(16)28-29-21)17-12-25-11-14-4-1-2-5-15(14)17;1-2-6-16-15(5-1)12-24-13-18(16)14-9-10-19-17(11-14)22(28-27-19)23-25-20-7-3-4-8-21(20)26-23;1-12-14(11-27)9-22-10-16(12)13-6-7-17-15(8-13)20(26-25-17)21-23-18-4-2-3-5-19(18)24-21/h1-2,5-11,16-18H,3-4,12-15H2,(H,31,32)(H,33,34);2-11,13,15,17,29,35H,12,14,16H2,1H3,(H,31,32)(H,33,34);1-2,5-11,14-16H,3-4,12-13,17H2,(H,30,31)(H,32,33);3-14H,15H2,1-2H3,(H,28,29)(H,30,31);2-11,13-14,26H,12H2,1H3,(H,28,29)(H,30,31);1-9,12-14,31H,10-11H2,(H,27,28)(H,29,30);1-12,30H,13H2,(H,26,27)(H,28,29);1-12H,(H,26,27)(H,28,29);1-13H,(H,25,26)(H,27,28);2-10,27H,11H2,1H3,(H,23,24)(H,25,26)
InChIKeyUTBONDCYJFMJSP-UHFFFAOYSA-N
MW4098.21 g/mol
LogP52.28
Rot. Bonds38

About 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline

4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline (PubChem CID 161185889) has the molecular formula C252H200ClN55O4 and a molecular weight of 4098.21 g/mol. Its IUPAC name is 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline.

Molecular Properties

Compound Name4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline
PubChem CID161185889
Molecular FormulaC252H200ClN55O4
Molecular Weight4098.21 g/mol
Exact Mass4094.68
IUPAC Name4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline
SMILESCC(CO)CNCc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.CN(C)Cc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.CNCc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.Cc1c(CO)cncc1-c1ccc2[nH]nc(-c3nc4ccccc4[nH]3)c2c1.Clc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.OCCc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.OCc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.c1ccc2c(-c3ccc4[nH]nc(-c5nc6c(CCN7CCCC7)cccc6[nH]5)c4c3)cncc2c1.c1ccc2c(-c3ccc4[nH]nc(-c5nc6c(CN7CCCC7)cccc6[nH]5)c4c3)cncc2c1.c1ccc2c(-c3ccc4[nH]nc(-c5nc6ccccc6[nH]5)c4c3)cncc2c1
InChIInChI=1S/C29H26N6.C28H26N6O.C28H24N6.C26H22N6.C25H20N6.C25H19N5O.C24H17N5O.C23H14ClN5.C23H15N5.C21H17N5O/c1-2-8-22-21(6-1)17-30-18-24(22)20-10-11-25-23(16-20)28(34-33-25)29-31-26-9-5-7-19(27(26)32-29)12-15-35-13-3-4-14-35;1-17(16-35)12-29-14-20-6-4-8-25-26(20)32-28(31-25)27-22-11-18(9-10-24(22)33-34-27)23-15-30-13-19-5-2-3-7-21(19)23;1-2-8-21-19(6-1)15-29-16-23(21)18-10-11-24-22(14-18)27(33-32-24)28-30-25-9-5-7-20(26(25)31-28)17-34-12-3-4-13-34;1-32(2)15-18-7-5-9-23-24(18)29-26(28-23)25-20-12-16(10-11-22(20)30-31-25)21-14-27-13-17-6-3-4-8-19(17)21;1-26-12-17-6-4-8-22-23(17)29-25(28-22)24-19-11-15(9-10-21(19)30-31-24)20-14-27-13-16-5-2-3-7-18(16)20;31-11-10-15-5-3-7-22-23(15)28-25(27-22)24-19-12-16(8-9-21(19)29-30-24)20-14-26-13-17-4-1-2-6-18(17)20;30-13-16-5-3-7-21-22(16)27-24(26-21)23-18-10-14(8-9-20(18)28-29-23)19-12-25-11-15-4-1-2-6-17(15)19;24-18-6-3-7-20-22(18)27-23(26-20)21-16-10-13(8-9-19(16)28-29-21)17-12-25-11-14-4-1-2-5-15(14)17;1-2-6-16-15(5-1)12-24-13-18(16)14-9-10-19-17(11-14)22(28-27-19)23-25-20-7-3-4-8-21(20)26-23;1-12-14(11-27)9-22-10-16(12)13-6-7-17-15(8-13)20(26-25-17)21-23-18-4-2-3-5-19(18)24-21/h1-2,5-11,16-18H,3-4,12-15H2,(H,31,32)(H,33,34);2-11,13,15,17,29,35H,12,14,16H2,1H3,(H,31,32)(H,33,34);1-2,5-11,14-16H,3-4,12-13,17H2,(H,30,31)(H,32,33);3-14H,15H2,1-2H3,(H,28,29)(H,30,31);2-11,13-14,26H,12H2,1H3,(H,28,29)(H,30,31);1-9,12-14,31H,10-11H2,(H,27,28)(H,29,30);1-12,30H,13H2,(H,26,27)(H,28,29);1-12H,(H,26,27)(H,28,29);1-13H,(H,25,26)(H,27,28);2-10,27H,11H2,1H3,(H,23,24)(H,25,26)
InChIKeyUTBONDCYJFMJSP-UHFFFAOYSA-N
XLogP52.28
TPSA817.20 Ų
H-Bond Donors26
H-Bond Acceptors39
Rotatable Bonds38
Heavy Atoms312
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004098.21
LogP ≤ 552.28
H-Bond Donors ≤ 526
H-Bond Acceptors ≤ 1039

Analyze 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline with MolForge

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Related Compounds

2-[2-[5-isoquinolin-4-yl-1-[[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methyl-methylamino]methyl]indazol-3-yl]-1H-benzimidazol-4-yl]ethanol
CID 146262284
CID 157287050
CID 157287050
4-tert-butyl-7-chloro-5-methyl-1H-indazole;4-tert-butyl-5-cyclopropyl-1H-indazol-3-amine;4-tert-butyl-3-ethyl-5-methyl-2H-indazole;4-tert-butyl-5-methyl-1H-pyrazolo[3,4-b]pyridine;4-tert-butyl-5-methyl-1H-pyrazolo[3,4-c]pyridine;4-tert-butyl-1H-pyrazolo[3,4-b]pyridine;4-tert-butyl-1H-pyrazolo[5,4-c]pyridine;4-tert-butyl-1H-pyrrolo[2,3-b]pyridine;8-tert-butylquinolin-6-ol
CID 157350573
[2-[5-isoquinolin-4-yl-1-[(4-methoxyphenyl)methyl]indazol-3-yl]-1H-benzimidazol-4-yl]methanol;4-[1-[(4-methoxyphenyl)methyl]-3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]indazol-5-yl]isoquinoline;pyrrolidine;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline
CID 157383395
CID 157528396
CID 157528396
4-[2-[5-[5-[(dimethylamino)methyl]-3-pyridinyl]-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridin-7-yl]cyclohexan-1-ol;1-[[5-[3-(7-piperazin-1-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methyl]piperidin-4-ol;7-piperazin-1-yl-2-[5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridine;7-piperazin-1-yl-2-[5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridine
CID 157659461
3-[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]propan-1-ol;(E)-3-[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]prop-2-en-1-ol;3-[5-[3-(1H-benzimidazol-2-yl)-1-methylindazol-5-yl]-4-methyl-3-pyridinyl]propan-1-ol;(E)-3-[5-[3-(1H-benzimidazol-2-yl)-1-methylindazol-5-yl]-4-methyl-3-pyridinyl]prop-2-en-1-ol
CID 157884116
4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;5-nitro-3-phenyl-1H-indazole;5-nitro-3-(1H-pyrrol-2-yl)-1H-indazole;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]quinoline;3-phenyl-5-pyridin-3-yl-1H-indazole;5-pyridin-4-yl-3-(1H-pyrrol-2-yl)-1H-indazole
CID 157991332
4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-N-benzylisoquinolin-8-amine;3-[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]propan-1-ol;5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-1,2,3,4-tetrahydro-1,7-naphthyridine;3-(1H-benzimidazol-2-yl)-5-(1H-indol-5-yl)-1H-indazole;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylethanamine
CID 158067419
1-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-5-yl]-1-quinoxalin-6-ylethanol;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[1-(1H-indol-3-yl)ethyl]-1,3-thiazole;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(4-pyrazol-1-ylphenyl)methyl]-1,3-thiazole;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[1-(4-pyrimidin-2-ylphenyl)ethyl]-1,3-thiazole;2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(quinoxalin-6-ylmethyl)-1,3-thiazole;1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-thiazol-5-yl]-1-quinoxalin-6-ylethanol;[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-thiazol-5-yl]-quinoxalin-6-ylmethanol;2-[(3E)-4-methylidene-3-prop-2-enylidenepiperidin-1-yl]-5-(1-pyridin-3-ylethyl)-1,3-thiazole
CID 158179250
[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methyl]morpholine;morpholine
CID 158209215
7-[Chloro-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-5-(3-chlorophenyl)-[1,2,4]triazolo[4,3-a]quinazoline;7-[(2-chloro-3-methylimidazol-4-yl)-(4-chlorophenyl)methyl]-5-(3-chlorophenyl)tetrazolo[1,5-a]quinoline;(4-chlorophenyl)-[5-(3-chlorophenyl)-4-methyltetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methanol;2-[[(4-chlorophenyl)-[5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-methylimidazol-4-yl)methyl]amino]ethanol;(4-chlorophenyl)-[5-(3-chlorophenyl)-[1,2,4]triazolo[4,3-a]quinazolin-7-yl]-(3-methylimidazol-4-yl)methanamine
CID 158278026

Frequently Asked Questions

What is the IUPAC name of 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline?
The IUPAC name of 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline (CID 161185889) is 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline.
What is the SMILES notation for 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline?
The canonical SMILES for 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline is CC(CO)CNCc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.CN(C)Cc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.CNCc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.Cc1c(CO)cncc1-c1ccc2[nH]nc(-c3nc4ccccc4[nH]3)c2c1.Clc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.OCCc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.OCc1cccc2[nH]c(-c3n[nH]c4ccc(-c5cncc6ccccc56)cc34)nc12.c1ccc2c(-c3ccc4[nH]nc(-c5nc6c(CCN7CCCC7)cccc6[nH]5)c4c3)cncc2c1.c1ccc2c(-c3ccc4[nH]nc(-c5nc6c(CN7CCCC7)cccc6[nH]5)c4c3)cncc2c1.c1ccc2c(-c3ccc4[nH]nc(-c5nc6ccccc6[nH]5)c4c3)cncc2c1.
What is the InChIKey of 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline?
The InChIKey is UTBONDCYJFMJSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N6.C28H26N6O.C28H24N6.C26H22N6.C25H20N6.C25H19N5O.C24H17N5O.C23H14ClN5.C23H15N5.C21H17N5O/c1-2-8-22-21(6-1)17-30-18-24(22)20-10-11-25-23(16-20)28(34-33-25)29-31-26-9-5-7-19(27(26)32-29)12-15-35-13-3-4-14-35;1-17(16-35)12-29-14-20-6-4-8-25-26(20)32-28(31-25)27-22-11-18(9-10-24(22)33-34-27)23-15-30-13-19-5-2-3-7-21(19)23;1-2-8-21-19(6-1)15-29-16-23(21)18-10-11-24-22(14-18)27(33-32-24)28-30-25-9-5-7-20(26(25)31-28)17-34-12-3-4-13-34;1-32(2)15-18-7-5-9-23-24(18)29-26(28-23)25-20-12-16(10-11-22(20)30-31-25)21-14-27-13-17-6-3-4-8-19(17)21;1-26-12-17-6-4-8-22-23(17)29-25(28-22)24-19-11-15(9-10-21(19)30-31-24)20-14-27-13-16-5-2-3-7-18(16)20;31-11-10-15-5-3-7-22-23(15)28-25(27-22)24-19-12-16(8-9-21(19)29-30-24)20-14-26-13-17-4-1-2-6-18(17)20;30-13-16-5-3-7-21-22(16)27-24(26-21)23-18-10-14(8-9-20(18)28-29-23)19-12-25-11-15-4-1-2-6-17(15)19;24-18-6-3-7-20-22(18)27-23(26-20)21-16-10-13(8-9-19(16)28-29-21)17-12-25-11-14-4-1-2-5-15(14)17;1-2-6-16-15(5-1)12-24-13-18(16)14-9-10-19-17(11-14)22(28-27-19)23-25-20-7-3-4-8-21(20)26-23;1-12-14(11-27)9-22-10-16(12)13-6-7-17-15(8-13)20(26-25-17)21-23-18-4-2-3-5-19(18)24-21/h1-2,5-11,16-18H,3-4,12-15H2,(H,31,32)(H,33,34);2-11,13,15,17,29,35H,12,14,16H2,1H3,(H,31,32)(H,33,34);1-2,5-11,14-16H,3-4,12-13,17H2,(H,30,31)(H,32,33);3-14H,15H2,1-2H3,(H,28,29)(H,30,31);2-11,13-14,26H,12H2,1H3,(H,28,29)(H,30,31);1-9,12-14,31H,10-11H2,(H,27,28)(H,29,30);1-12,30H,13H2,(H,26,27)(H,28,29);1-12H,(H,26,27)(H,28,29);1-13H,(H,25,26)(H,27,28);2-10,27H,11H2,1H3,(H,23,24)(H,25,26).
What are the key properties of 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline?
4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline has a molecular weight of 4098.21 g/mol, XLogP of 52.28, 38 rotatable bonds, 26 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;[5-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-4-methyl-3-pyridinyl]methanol;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N,N-dimethylmethanamine;2-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]ethanol;[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methanol;3-[[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]methylamino]-2-methylpropan-1-ol;1-[2-(5-isoquinolin-4-yl-1H-indazol-3-yl)-1H-benzimidazol-4-yl]-N-methylmethanamine;4-[3-[4-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline;4-[3-[4-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]isoquinoline is sourced from PubChem (CID 161185889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).