2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole

C242H228Ir8N29O13-11 — CID 157483897

IUPAC2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole
SMILESCOC(=O)C(C)(C)CC(C)(CCC(C)C#N)C(=O)OCCOc1cc(C)c(-n2ccnc2-c2[c-]cccc2)c(C)c1.COC(=O)C(C)(C)CC(C)(CCC(C)c1ccccc1)C(=O)OCCOc1c[c-]c(-c2nccn2-c2ccccc2C)cc1.Cc1cc(C)c(-c2cnc3c4[c-]cccc4c4ccc(C)cc4n23)c(C)c1.Cc1cc(C)c(-n2cc(-c3c(C)cccc3C)nc2-c2[c-]con2)c(C)c1.Cc1cc(Cc2cccc3c2oc2ccccc23)cc(C)c1-n1ccnc1-c1[c-]cccc1.Cc1ccccc1-c1cc[c-]c2c1c1ccccc1n1c(-c3ccc(C(C)C)cc3C)cnc21.Cc1ccccc1-n1ccnc1-c1[c-]ccc2c1oc1ccccc12.Cc1nc(-n2ncnc2-n2[c-]ccn2)n(C)c1C.Cn1ccnc1-c1[c-]cccc1.Cn1ccnc1-c1[c-]cccc1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-n1cccn1
InChIInChI=1S/C37H43N2O5.C33H40N3O5.C32H27N2.C30H23N2O.C25H21N2.C23H22N3O.C22H15N2O.C11H12N7.2C10H9N2.C9H7N2.8Ir/c1-27(29-13-8-7-9-14-29)20-21-37(5,26-36(3,4)34(40)42-6)35(41)44-25-24-43-31-18-16-30(17-19-31)33-38-22-23-39(33)32-15-11-10-12-28(32)2;1-23(21-34)13-14-33(6,22-32(4,5)30(37)39-7)31(38)41-18-17-40-27-19-24(2)28(25(3)20-27)36-16-15-35-29(36)26-11-9-8-10-12-26;1-20(2)23-16-17-25(22(4)18-23)30-19-33-32-28-14-9-13-26(24-11-6-5-10-21(24)3)31(28)27-12-7-8-15-29(27)34(30)32;1-20-17-22(19-24-11-8-13-26-25-12-6-7-14-27(25)33-29(24)26)18-21(2)28(20)32-16-15-31-30(32)23-9-4-3-5-10-23;1-15-9-10-20-19-7-5-6-8-21(19)25-26-14-23(27(25)22(20)13-15)24-17(3)11-16(2)12-18(24)4;1-14-11-17(4)22(18(5)12-14)26-13-20(21-15(2)7-6-8-16(21)3)24-23(26)19-9-10-27-25-19;1-15-7-2-4-11-19(15)24-14-13-23-22(24)18-10-6-9-17-16-8-3-5-12-20(16)25-21(17)18;1-8-9(2)16(3)11(15-8)18-10(12-7-14-18)17-6-4-5-13-17;2*1-12-8-7-11-10(12)9-5-3-2-4-6-9;1-2-5-9(6-3-1)11-8-4-7-10-11;;;;;;;;/h7-16,18-19,22-23,27H,20-21,24-26H2,1-6H3;8-11,15-16,19-20,23H,13-14,17-18,22H2,1-7H3;5-13,15-20H,1-4H3;3-9,11-18H,19H2,1-2H3;5-7,9-14H,1-4H3;6-8,10-13H,1-5H3;2-9,11-14H,1H3;4-5,7H,1-3H3;2*2-5,7-8H,1H3;1-5,7-8H;;;;;;;;/q11*-1;;;;;;;;
InChIKeyLALKYJYCEKXDAY-UHFFFAOYSA-N
MW5288.41 g/mol
LogP53.58
Rot. Bonds45

About 2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole

2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole (PubChem CID 157483897) has the molecular formula C242H228Ir8N29O13-11 and a molecular weight of 5288.41 g/mol. Its IUPAC name is 2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole.

Molecular Properties

Compound Name2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole
PubChem CID157483897
Molecular FormulaC242H228Ir8N29O13-11
Molecular Weight5288.41 g/mol
Exact Mass5291.52
IUPAC Name2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole
SMILESCOC(=O)C(C)(C)CC(C)(CCC(C)C#N)C(=O)OCCOc1cc(C)c(-n2ccnc2-c2[c-]cccc2)c(C)c1.COC(=O)C(C)(C)CC(C)(CCC(C)c1ccccc1)C(=O)OCCOc1c[c-]c(-c2nccn2-c2ccccc2C)cc1.Cc1cc(C)c(-c2cnc3c4[c-]cccc4c4ccc(C)cc4n23)c(C)c1.Cc1cc(C)c(-n2cc(-c3c(C)cccc3C)nc2-c2[c-]con2)c(C)c1.Cc1cc(Cc2cccc3c2oc2ccccc23)cc(C)c1-n1ccnc1-c1[c-]cccc1.Cc1ccccc1-c1cc[c-]c2c1c1ccccc1n1c(-c3ccc(C(C)C)cc3C)cnc21.Cc1ccccc1-n1ccnc1-c1[c-]ccc2c1oc1ccccc12.Cc1nc(-n2ncnc2-n2[c-]ccn2)n(C)c1C.Cn1ccnc1-c1[c-]cccc1.Cn1ccnc1-c1[c-]cccc1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-n1cccn1
InChIInChI=1S/C37H43N2O5.C33H40N3O5.C32H27N2.C30H23N2O.C25H21N2.C23H22N3O.C22H15N2O.C11H12N7.2C10H9N2.C9H7N2.8Ir/c1-27(29-13-8-7-9-14-29)20-21-37(5,26-36(3,4)34(40)42-6)35(41)44-25-24-43-31-18-16-30(17-19-31)33-38-22-23-39(33)32-15-11-10-12-28(32)2;1-23(21-34)13-14-33(6,22-32(4,5)30(37)39-7)31(38)41-18-17-40-27-19-24(2)28(25(3)20-27)36-16-15-35-29(36)26-11-9-8-10-12-26;1-20(2)23-16-17-25(22(4)18-23)30-19-33-32-28-14-9-13-26(24-11-6-5-10-21(24)3)31(28)27-12-7-8-15-29(27)34(30)32;1-20-17-22(19-24-11-8-13-26-25-12-6-7-14-27(25)33-29(24)26)18-21(2)28(20)32-16-15-31-30(32)23-9-4-3-5-10-23;1-15-9-10-20-19-7-5-6-8-21(19)25-26-14-23(27(25)22(20)13-15)24-17(3)11-16(2)12-18(24)4;1-14-11-17(4)22(18(5)12-14)26-13-20(21-15(2)7-6-8-16(21)3)24-23(26)19-9-10-27-25-19;1-15-7-2-4-11-19(15)24-14-13-23-22(24)18-10-6-9-17-16-8-3-5-12-20(16)25-21(17)18;1-8-9(2)16(3)11(15-8)18-10(12-7-14-18)17-6-4-5-13-17;2*1-12-8-7-11-10(12)9-5-3-2-4-6-9;1-2-5-9(6-3-1)11-8-4-7-10-11;;;;;;;;/h7-16,18-19,22-23,27H,20-21,24-26H2,1-6H3;8-11,15-16,19-20,23H,13-14,17-18,22H2,1-7H3;5-13,15-20H,1-4H3;3-9,11-18H,19H2,1-2H3;5-7,9-14H,1-4H3;6-8,10-13H,1-5H3;2-9,11-14H,1H3;4-5,7H,1-3H3;2*2-5,7-8H,1H3;1-5,7-8H;;;;;;;;/q11*-1;;;;;;;;
InChIKeyLALKYJYCEKXDAY-UHFFFAOYSA-N
XLogP53.58
TPSA443.27 Ų
H-Bond Donors
H-Bond Acceptors42
Rotatable Bonds45
Heavy Atoms292
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005288.41
LogP ≤ 553.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1042

Analyze 2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole?
The IUPAC name of 2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole (CID 157483897) is 2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole.
What is the SMILES notation for 2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole?
The canonical SMILES for 2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole is COC(=O)C(C)(C)CC(C)(CCC(C)C#N)C(=O)OCCOc1cc(C)c(-n2ccnc2-c2[c-]cccc2)c(C)c1.COC(=O)C(C)(C)CC(C)(CCC(C)c1ccccc1)C(=O)OCCOc1c[c-]c(-c2nccn2-c2ccccc2C)cc1.Cc1cc(C)c(-c2cnc3c4[c-]cccc4c4ccc(C)cc4n23)c(C)c1.Cc1cc(C)c(-n2cc(-c3c(C)cccc3C)nc2-c2[c-]con2)c(C)c1.Cc1cc(Cc2cccc3c2oc2ccccc23)cc(C)c1-n1ccnc1-c1[c-]cccc1.Cc1ccccc1-c1cc[c-]c2c1c1ccccc1n1c(-c3ccc(C(C)C)cc3C)cnc21.Cc1ccccc1-n1ccnc1-c1[c-]ccc2c1oc1ccccc12.Cc1nc(-n2ncnc2-n2[c-]ccn2)n(C)c1C.Cn1ccnc1-c1[c-]cccc1.Cn1ccnc1-c1[c-]cccc1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-n1cccn1.
What is the InChIKey of 2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole?
The InChIKey is LALKYJYCEKXDAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H43N2O5.C33H40N3O5.C32H27N2.C30H23N2O.C25H21N2.C23H22N3O.C22H15N2O.C11H12N7.2C10H9N2.C9H7N2.8Ir/c1-27(29-13-8-7-9-14-29)20-21-37(5,26-36(3,4)34(40)42-6)35(41)44-25-24-43-31-18-16-30(17-19-31)33-38-22-23-39(33)32-15-11-10-12-28(32)2;1-23(21-34)13-14-33(6,22-32(4,5)30(37)39-7)31(38)41-18-17-40-27-19-24(2)28(25(3)20-27)36-16-15-35-29(36)26-11-9-8-10-12-26;1-20(2)23-16-17-25(22(4)18-23)30-19-33-32-28-14-9-13-26(24-11-6-5-10-21(24)3)31(28)27-12-7-8-15-29(27)34(30)32;1-20-17-22(19-24-11-8-13-26-25-12-6-7-14-27(25)33-29(24)26)18-21(2)28(20)32-16-15-31-30(32)23-9-4-3-5-10-23;1-15-9-10-20-19-7-5-6-8-21(19)25-26-14-23(27(25)22(20)13-15)24-17(3)11-16(2)12-18(24)4;1-14-11-17(4)22(18(5)12-14)26-13-20(21-15(2)7-6-8-16(21)3)24-23(26)19-9-10-27-25-19;1-15-7-2-4-11-19(15)24-14-13-23-22(24)18-10-6-9-17-16-8-3-5-12-20(16)25-21(17)18;1-8-9(2)16(3)11(15-8)18-10(12-7-14-18)17-6-4-5-13-17;2*1-12-8-7-11-10(12)9-5-3-2-4-6-9;1-2-5-9(6-3-1)11-8-4-7-10-11;;;;;;;;/h7-16,18-19,22-23,27H,20-21,24-26H2,1-6H3;8-11,15-16,19-20,23H,13-14,17-18,22H2,1-7H3;5-13,15-20H,1-4H3;3-9,11-18H,19H2,1-2H3;5-7,9-14H,1-4H3;6-8,10-13H,1-5H3;2-9,11-14H,1H3;4-5,7H,1-3H3;2*2-5,7-8H,1H3;1-5,7-8H;;;;;;;;/q11*-1;;;;;;;;.
What are the key properties of 2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole?
2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole has a molecular weight of 5288.41 g/mol, XLogP of 53.58, 45 rotatable bonds, 0 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3H-dibenzofuran-3-id-4-yl)-1-(2-methylphenyl)imidazole;1-[4-(dibenzofuran-4-ylmethyl)-2,6-dimethylphenyl]-2-phenylimidazole;1-O-[2-[3,5-dimethyl-4-(2-phenylimidazol-1-yl)phenoxy]ethyl] 5-O-methyl 2-(3-cyanobutyl)-2,4,4-trimethylpentanedioate;3-[4-(2,6-dimethylphenyl)-1-(2,4,6-trimethylphenyl)imidazol-2-yl]-4H-1,2-oxazol-4-ide;octakis(iridium);1-O-methyl 5-O-[2-[4-[1-(2-methylphenyl)imidazol-2-yl]benzene-5-id-1-yl]oxyethyl] 2,2,4-trimethyl-4-(3-phenylbutyl)pentanedioate;bis(1-methyl-2-phenylimidazole);9-(2-methylphenyl)-3-(2-methyl-4-propan-2-ylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;6-methyl-3-(2,4,6-trimethylphenyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-phenylpyrazole;5-(3H-pyrazol-3-id-2-yl)-1-(1,4,5-trimethylimidazol-2-yl)-1,2,4-triazole is sourced from PubChem (CID 157483897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).