8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane

C218H229F3Ge4Ir4N16O4-8 — CID 160937484

IUPAC8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane
SMILESCC(C)c1cccc(C(C)C)c1-n1c(-c2[c-]ccc3c2oc2nc(C(F)(F)F)ccc23)nc2c(C(C)C)cccc21.CCC(C)Cc1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)C.C[Ge](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CCCC1.C[Ge](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.Cc1c[c-]c(-c2ccc([Ge](C)(C)C)cn2)cc1.Cc1cc(C)c(-n2c(-c3[c-]cc(C)c4c3oc3nc(C(C)(C)C)ccc34)nc3ccc(C)cc32)c(C)c1.Cc1cccc(C)c1-c1ccc2c(n1)oc1c(-c3nc4cc(C(C)C)ccc4n3Cc3ccccc3)[c-]ccc12.Cc1cccc(C)c1-c1ccc2c(n1)oc1c(-c3nc4ccc(C(C)C)cc4n3-c3ccc(C(C)(C)C)cc3)[c-]cc(C)c12.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C40H38N3O.C36H30N3O.C34H31F3N3O.C33H32N3O.C21H28GeN.C20H26GeN.C19H26GeN.C15H18GeN.4Ir/c1-23(2)27-13-20-32-34(22-27)43(29-16-14-28(15-17-29)40(6,7)8)38(41-32)31-18-12-26(5)36-30-19-21-33(42-39(30)44-37(31)36)35-24(3)10-9-11-25(35)4;1-22(2)26-16-19-32-31(20-26)37-35(39(32)21-25-12-6-5-7-13-25)29-15-9-14-27-28-17-18-30(38-36(28)40-34(27)29)33-23(3)10-8-11-24(33)4;1-18(2)21-10-9-15-27-29(21)39-32(40(27)30-22(19(3)4)11-7-12-23(30)20(5)6)26-14-8-13-24-25-16-17-28(34(35,36)37)38-33(25)41-31(24)26;1-18-9-13-25-26(17-18)36(29-21(4)15-19(2)16-22(29)5)31(34-25)24-11-10-20(3)28-23-12-14-27(33(6,7)8)35-32(23)37-30(24)28;1-22(2,3)20-16-23-21(18-12-8-5-9-13-18)15-19(20)14-17-10-6-4-7-11-17;1-21(2,3)19-15-22-20(17-11-5-4-6-12-17)14-18(19)13-16-9-7-8-10-16;1-6-15(2)12-17-13-19(16-10-8-7-9-11-16)21-14-18(17)20(3,4)5;1-12-5-7-13(8-6-12)15-10-9-14(11-17-15)16(2,3)4;;;;/h9-17,19-23H,1-8H3;5-14,16-20,22H,21H2,1-4H3;7-13,15-20H,1-6H3;9-10,12-17H,1-8H3;5,8-9,12,15-17H,4,6-7,10-11,14H2,1-3H3;4-6,11,14-16H,7-10,13H2,1-3H3;7-10,13-15H,6,12H2,1-5H3;5-7,9-11H,1-4H3;;;;/q8*-1;;;;
InChIKeyBMNJFTCOAWTOPS-UHFFFAOYSA-N
MW4253.64 g/mol
LogP56.97
Rot. Bonds31

About 8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane

8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane (PubChem CID 160937484) has the molecular formula C218H229F3Ge4Ir4N16O4-8 and a molecular weight of 4253.64 g/mol. Its IUPAC name is 8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane.

Molecular Properties

Compound Name8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane
PubChem CID160937484
Molecular FormulaC218H229F3Ge4Ir4N16O4-8
Molecular Weight4253.64 g/mol
Exact Mass4259.36
IUPAC Name8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane
SMILESCC(C)c1cccc(C(C)C)c1-n1c(-c2[c-]ccc3c2oc2nc(C(F)(F)F)ccc23)nc2c(C(C)C)cccc21.CCC(C)Cc1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)C.C[Ge](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CCCC1.C[Ge](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.Cc1c[c-]c(-c2ccc([Ge](C)(C)C)cn2)cc1.Cc1cc(C)c(-n2c(-c3[c-]cc(C)c4c3oc3nc(C(C)(C)C)ccc34)nc3ccc(C)cc32)c(C)c1.Cc1cccc(C)c1-c1ccc2c(n1)oc1c(-c3nc4cc(C(C)C)ccc4n3Cc3ccccc3)[c-]ccc12.Cc1cccc(C)c1-c1ccc2c(n1)oc1c(-c3nc4ccc(C(C)C)cc4n3-c3ccc(C(C)(C)C)cc3)[c-]cc(C)c12.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C40H38N3O.C36H30N3O.C34H31F3N3O.C33H32N3O.C21H28GeN.C20H26GeN.C19H26GeN.C15H18GeN.4Ir/c1-23(2)27-13-20-32-34(22-27)43(29-16-14-28(15-17-29)40(6,7)8)38(41-32)31-18-12-26(5)36-30-19-21-33(42-39(30)44-37(31)36)35-24(3)10-9-11-25(35)4;1-22(2)26-16-19-32-31(20-26)37-35(39(32)21-25-12-6-5-7-13-25)29-15-9-14-27-28-17-18-30(38-36(28)40-34(27)29)33-23(3)10-8-11-24(33)4;1-18(2)21-10-9-15-27-29(21)39-32(40(27)30-22(19(3)4)11-7-12-23(30)20(5)6)26-14-8-13-24-25-16-17-28(34(35,36)37)38-33(25)41-31(24)26;1-18-9-13-25-26(17-18)36(29-21(4)15-19(2)16-22(29)5)31(34-25)24-11-10-20(3)28-23-12-14-27(33(6,7)8)35-32(23)37-30(24)28;1-22(2,3)20-16-23-21(18-12-8-5-9-13-18)15-19(20)14-17-10-6-4-7-11-17;1-21(2,3)19-15-22-20(17-11-5-4-6-12-17)14-18(19)13-16-9-7-8-10-16;1-6-15(2)12-17-13-19(16-10-8-7-9-11-16)21-14-18(17)20(3,4)5;1-12-5-7-13(8-6-12)15-10-9-14(11-17-15)16(2,3)4;;;;/h9-17,19-23H,1-8H3;5-14,16-20,22H,21H2,1-4H3;7-13,15-20H,1-6H3;9-10,12-17H,1-8H3;5,8-9,12,15-17H,4,6-7,10-11,14H2,1-3H3;4-6,11,14-16H,7-10,13H2,1-3H3;7-10,13-15H,6,12H2,1-5H3;5-7,9-11H,1-4H3;;;;/q8*-1;;;;
InChIKeyBMNJFTCOAWTOPS-UHFFFAOYSA-N
XLogP56.97
TPSA226.96 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds31
Heavy Atoms249
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004253.64
LogP ≤ 556.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane?
The IUPAC name of 8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane (CID 160937484) is 8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane.
What is the SMILES notation for 8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane?
The canonical SMILES for 8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane is CC(C)c1cccc(C(C)C)c1-n1c(-c2[c-]ccc3c2oc2nc(C(F)(F)F)ccc23)nc2c(C(C)C)cccc21.CCC(C)Cc1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)C.C[Ge](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CCCC1.C[Ge](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.Cc1c[c-]c(-c2ccc([Ge](C)(C)C)cn2)cc1.Cc1cc(C)c(-n2c(-c3[c-]cc(C)c4c3oc3nc(C(C)(C)C)ccc34)nc3ccc(C)cc32)c(C)c1.Cc1cccc(C)c1-c1ccc2c(n1)oc1c(-c3nc4cc(C(C)C)ccc4n3Cc3ccccc3)[c-]ccc12.Cc1cccc(C)c1-c1ccc2c(n1)oc1c(-c3nc4ccc(C(C)C)cc4n3-c3ccc(C(C)(C)C)cc3)[c-]cc(C)c12.[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of 8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane?
The InChIKey is BMNJFTCOAWTOPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H38N3O.C36H30N3O.C34H31F3N3O.C33H32N3O.C21H28GeN.C20H26GeN.C19H26GeN.C15H18GeN.4Ir/c1-23(2)27-13-20-32-34(22-27)43(29-16-14-28(15-17-29)40(6,7)8)38(41-32)31-18-12-26(5)36-30-19-21-33(42-39(30)44-37(31)36)35-24(3)10-9-11-25(35)4;1-22(2)26-16-19-32-31(20-26)37-35(39(32)21-25-12-6-5-7-13-25)29-15-9-14-27-28-17-18-30(38-36(28)40-34(27)29)33-23(3)10-8-11-24(33)4;1-18(2)21-10-9-15-27-29(21)39-32(40(27)30-22(19(3)4)11-7-12-23(30)20(5)6)26-14-8-13-24-25-16-17-28(34(35,36)37)38-33(25)41-31(24)26;1-18-9-13-25-26(17-18)36(29-21(4)15-19(2)16-22(29)5)31(34-25)24-11-10-20(3)28-23-12-14-27(33(6,7)8)35-32(23)37-30(24)28;1-22(2,3)20-16-23-21(18-12-8-5-9-13-18)15-19(20)14-17-10-6-4-7-11-17;1-21(2,3)19-15-22-20(17-11-5-4-6-12-17)14-18(19)13-16-9-7-8-10-16;1-6-15(2)12-17-13-19(16-10-8-7-9-11-16)21-14-18(17)20(3,4)5;1-12-5-7-13(8-6-12)15-10-9-14(11-17-15)16(2,3)4;;;;/h9-17,19-23H,1-8H3;5-14,16-20,22H,21H2,1-4H3;7-13,15-20H,1-6H3;9-10,12-17H,1-8H3;5,8-9,12,15-17H,4,6-7,10-11,14H2,1-3H3;4-6,11,14-16H,7-10,13H2,1-3H3;7-10,13-15H,6,12H2,1-5H3;5-7,9-11H,1-4H3;;;;/q8*-1;;;;.
What are the key properties of 8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane?
8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane has a molecular weight of 4253.64 g/mol, XLogP of 56.97, 31 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-benzyl-5-propan-2-ylbenzimidazol-2-yl)-2-(2,6-dimethylphenyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;2-tert-butyl-5-methyl-8-[6-methyl-1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-tert-butylphenyl)-6-propan-2-ylbenzimidazol-2-yl]-2-(2,6-dimethylphenyl)-5-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[4-(cyclohexylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;[4-(cyclopentylmethyl)-6-phenyl-3-pyridinyl]-trimethylgermane;8-[1-[2,6-di(propan-2-yl)phenyl]-4-propan-2-ylbenzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]germane;trimethyl-[4-(2-methylbutyl)-6-phenyl-3-pyridinyl]germane is sourced from PubChem (CID 160937484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).