11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum

C195H164N33OPt7S-21 — CID 158000607

IUPAC11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum
SMILESCC1=CN(C)[CH-]N1c1[c-]c(N2c3[c-]c(-n4cc(C)cn4)ccc3CCc3ccccc32)ccc1.CN1C=CN(c2[c-]c(N3c4[c-]c(-c5nccn5C)ccc4CCc4ccccc43)ccc2)[CH-]1.CN1C=CN(c2[c-]c(N3c4[c-]c(-c5nccn5C)ccc4CCc4ccccc43)ccc2)[CH-]1.CN1C=CN(c2[c-]c(N3c4[c-]c(-c5ncco5)ccc4CCc4ccccc43)ccc2)[CH-]1.CN1C=CN(c2[c-]c(N3c4[c-]c(-c5nccs5)ccc4CCc4ccccc43)ccc2)[CH-]1.CN1C=CN(c2[c-]c(N3c4[c-]c(-n5cccn5)ccc4CCc4ccccc43)ccc2)[CH-]1.Cc1cc(C)n(-c2[c-]c3c(cc2)CCc2ccccc2N3c2[c-]c(N3C=CN(C)[CH-]3)ccc2)n1.[Pt].[Pt].[Pt].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C29H26N5.2C28H24N5.C27H22N5.C27H21N4O.C27H21N4S.7Pt/c1-21-17-30-33(18-21)26-14-13-24-12-11-23-7-4-5-10-28(23)34(29(24)16-26)27-9-6-8-25(15-27)32-20-31(3)19-22(32)2;1-21-17-22(2)34(30-21)27-14-13-24-12-11-23-7-4-5-10-28(23)33(29(24)19-27)26-9-6-8-25(18-26)32-16-15-31(3)20-32;2*1-30-16-17-32(20-30)24-7-5-8-25(19-24)33-26-9-4-3-6-21(26)10-11-22-12-13-23(18-27(22)33)28-29-14-15-31(28)2;1-29-16-17-30(20-29)23-7-4-8-25(18-23)32-26-9-3-2-6-21(26)10-11-22-12-13-24(19-27(22)32)31-15-5-14-28-31;2*1-29-14-15-30(19-29)23-6-4-7-24(18-23)31-25-8-3-2-5-20(25)9-10-21-11-12-22(17-26(21)31)27-28-13-16-32-27;;;;;;;/h4-10,13-14,17-20H,11-12H2,1-3H3;4-10,13-17,20H,11-12H2,1-3H3;2*3-9,12-17,20H,10-11H2,1-2H3;2-9,12-17,20H,10-11H2,1H3;2*2-8,11-16,19H,9-10H2,1H3;;;;;;;/q7*-3;;;;;;;
InChIKeyLZUIZQJVDCBCAD-UHFFFAOYSA-N
MW4383.30 g/mol
LogP40.82
Rot. Bonds21

About 11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum

11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum (PubChem CID 158000607) has the molecular formula C195H164N33OPt7S-21 and a molecular weight of 4383.30 g/mol. Its IUPAC name is 11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum.

Molecular Properties

Compound Name11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum
PubChem CID158000607
Molecular FormulaC195H164N33OPt7S-21
Molecular Weight4383.30 g/mol
Exact Mass4380.12
IUPAC Name11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum
SMILESCC1=CN(C)[CH-]N1c1[c-]c(N2c3[c-]c(-n4cc(C)cn4)ccc3CCc3ccccc32)ccc1.CN1C=CN(c2[c-]c(N3c4[c-]c(-c5nccn5C)ccc4CCc4ccccc43)ccc2)[CH-]1.CN1C=CN(c2[c-]c(N3c4[c-]c(-c5nccn5C)ccc4CCc4ccccc43)ccc2)[CH-]1.CN1C=CN(c2[c-]c(N3c4[c-]c(-c5ncco5)ccc4CCc4ccccc43)ccc2)[CH-]1.CN1C=CN(c2[c-]c(N3c4[c-]c(-c5nccs5)ccc4CCc4ccccc43)ccc2)[CH-]1.CN1C=CN(c2[c-]c(N3c4[c-]c(-n5cccn5)ccc4CCc4ccccc43)ccc2)[CH-]1.Cc1cc(C)n(-c2[c-]c3c(cc2)CCc2ccccc2N3c2[c-]c(N3C=CN(C)[CH-]3)ccc2)n1.[Pt].[Pt].[Pt].[Pt].[Pt].[Pt].[Pt]
InChIInChI=1S/2C29H26N5.2C28H24N5.C27H22N5.C27H21N4O.C27H21N4S.7Pt/c1-21-17-30-33(18-21)26-14-13-24-12-11-23-7-4-5-10-28(23)34(29(24)16-26)27-9-6-8-25(15-27)32-20-31(3)19-22(32)2;1-21-17-22(2)34(30-21)27-14-13-24-12-11-23-7-4-5-10-28(23)33(29(24)19-27)26-9-6-8-25(18-26)32-16-15-31(3)20-32;2*1-30-16-17-32(20-30)24-7-5-8-25(19-24)33-26-9-4-3-6-21(26)10-11-22-12-13-23(18-27(22)33)28-29-14-15-31(28)2;1-29-16-17-30(20-29)23-7-4-8-25(18-23)32-26-9-3-2-6-21(26)10-11-22-12-13-24(19-27(22)32)31-15-5-14-28-31;2*1-29-14-15-30(19-29)23-6-4-7-24(18-23)31-25-8-3-2-5-20(25)9-10-21-11-12-22(17-26(21)31)27-28-13-16-32-27;;;;;;;/h4-10,13-14,17-20H,11-12H2,1-3H3;4-10,13-17,20H,11-12H2,1-3H3;2*3-9,12-17,20H,10-11H2,1-2H3;2-9,12-17,20H,10-11H2,1H3;2*2-8,11-16,19H,9-10H2,1H3;;;;;;;/q7*-3;;;;;;;
InChIKeyLZUIZQJVDCBCAD-UHFFFAOYSA-N
XLogP40.82
TPSA196.06 Ų
H-Bond Donors
H-Bond Acceptors35
Rotatable Bonds21
Heavy Atoms237
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004383.30
LogP ≤ 540.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1035

Computed Properties (RDKit)

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

Analyze 11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum with MolForge

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Related Compounds

CID 161280549
CID 161280549
2-(2,4-Difluorobenzene-6-id-1-yl)pyridine;tetrakis(iridium);2-phenyl-1,3-benzothiazole;2-phenyl-1,3-oxazole;bis(1-phenylpyrazole);1-phenyltriazole;platinum;2-[3-(trifluoromethyl)benzene-6-id-1-yl]pyridine;1,4,5-trimethyl-2-phenylimidazole
CID 161788827
2-[3-[3-(3,5-dimethyl-4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-[3-(3,5-dimethyl-4-pyridin-4-ylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-thiazole;2-[3-methyl-1-[3-[3-(3-methyl-4-pyridin-2-yl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-imidazol-2-id-4-yl]pyridine;3-[3-methyl-1-[3-[3-(3-methyl-4-pyridin-3-yl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-2H-imidazol-2-id-4-yl]pyridine;tris(platinum(2+));bis(platinum(4+));2-[3-[3-(4-pyridin-4-ylpyrazol-1-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]-1,3-oxazole
CID 157247486
1,2-dimethylimidazole;1,2-dimethylpyrrole;1,3-dimethylpyrrole;2-methylfuran;3-methylfuran;2-methyl-1,3,4-oxadiazole;2-methyl-1,3-oxazole;4-methyl-1,3-oxazole;2-methylpyrazine;3-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-2H-pyrrole;2-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;toluene
CID 157283462
1,2-dimethylimidazole;1,2-dimethylpyrrole;methane;tris(2-methylcyclopenta-1,3-diene);2-methylfuran;3-methylfuran;bis(2-methyl-1,3-oxazole);2-methylpyrazine;3-methylpyridazine;bis(2-methylpyridine);3-methylpyridine;2-methylpyrimidine;5-methyl-3H-pyrrole;2-methyl-1,3-thiazole;2-methylthiophene;toluene
CID 157358559
Bis(9-methylcarbazole);bis(9-methylpyrido[2,3-b]indole);tetrakis(platinum(2+));bis(2-[3-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxybenzene-2-id-1-yl]-1,3-oxazole);bis(2-[3-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxybenzene-2-id-1-yl]-1,3-thiazole)
CID 157474352
CID 157525435
CID 157525435
CID 157555385
CID 157555385
11-[3-(3,5-dimethylpyrazol-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-(3-pyrazol-1-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3-methyl-2H-imidazol-2-id-1-yl)-11-(3-pyrazol-1-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(3-pyrazol-1-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(4-phenylpyrazol-1-yl)-11-(3-pyrazol-1-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum;heptakis(platinum(2+));2-[11-(3-pyrazol-1-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-(3-pyrazol-1-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;2-pyrazol-1-yl-11-(3-pyrazol-1-ylbenzene-2-id-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide
CID 157556205
Tert-butylbenzene;2-tert-butyl-1,3-oxazole;2-tert-butylpyrazine;3-tert-butylpyridazine;4-tert-butylpyridazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;2-tert-butyl-1,3-thiazole;ethane
CID 157698182
2-(3-methyl-2H-imidazol-2-id-1-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;2-(1-methylimidazol-2-yl)-11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-ide;platinum;tris(platinum(2+));2-[11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole
CID 157706845
CID 157712262
CID 157712262

Frequently Asked Questions

What is the IUPAC name of 11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum?
The IUPAC name of 11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum (CID 158000607) is 11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum.
What is the SMILES notation for 11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum?
The canonical SMILES for 11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum is CC1=CN(C)[CH-]N1c1[c-]c(N2c3[c-]c(-n4cc(C)cn4)ccc3CCc3ccccc32)ccc1.CN1C=CN(c2[c-]c(N3c4[c-]c(-c5nccn5C)ccc4CCc4ccccc43)ccc2)[CH-]1.CN1C=CN(c2[c-]c(N3c4[c-]c(-c5nccn5C)ccc4CCc4ccccc43)ccc2)[CH-]1.CN1C=CN(c2[c-]c(N3c4[c-]c(-c5ncco5)ccc4CCc4ccccc43)ccc2)[CH-]1.CN1C=CN(c2[c-]c(N3c4[c-]c(-c5nccs5)ccc4CCc4ccccc43)ccc2)[CH-]1.CN1C=CN(c2[c-]c(N3c4[c-]c(-n5cccn5)ccc4CCc4ccccc43)ccc2)[CH-]1.Cc1cc(C)n(-c2[c-]c3c(cc2)CCc2ccccc2N3c2[c-]c(N3C=CN(C)[CH-]3)ccc2)n1.[Pt].[Pt].[Pt].[Pt].[Pt].[Pt].[Pt].
What is the InChIKey of 11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum?
The InChIKey is LZUIZQJVDCBCAD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C29H26N5.2C28H24N5.C27H22N5.C27H21N4O.C27H21N4S.7Pt/c1-21-17-30-33(18-21)26-14-13-24-12-11-23-7-4-5-10-28(23)34(29(24)16-26)27-9-6-8-25(15-27)32-20-31(3)19-22(32)2;1-21-17-22(2)34(30-21)27-14-13-24-12-11-23-7-4-5-10-28(23)33(29(24)19-27)26-9-6-8-25(18-26)32-16-15-31(3)20-32;2*1-30-16-17-32(20-30)24-7-5-8-25(19-24)33-26-9-4-3-6-21(26)10-11-22-12-13-23(18-27(22)33)28-29-14-15-31(28)2;1-29-16-17-30(20-29)23-7-4-8-25(18-23)32-26-9-3-2-6-21(26)10-11-22-12-13-24(19-27(22)32)31-15-5-14-28-31;2*1-29-14-15-30(19-29)23-6-4-7-24(18-23)31-25-8-3-2-5-20(25)9-10-21-11-12-22(17-26(21)31)27-28-13-16-32-27;;;;;;;/h4-10,13-14,17-20H,11-12H2,1-3H3;4-10,13-17,20H,11-12H2,1-3H3;2*3-9,12-17,20H,10-11H2,1-2H3;2-9,12-17,20H,10-11H2,1H3;2*2-8,11-16,19H,9-10H2,1H3;;;;;;;/q7*-3;;;;;;;.
What are the key properties of 11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum?
11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum has a molecular weight of 4383.30 g/mol, XLogP of 40.82, 21 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[3-(3,5-dimethyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(4-methylpyrazol-1-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-(3,5-dimethylpyrazol-1-yl)-11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-oxazole;2-[11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-5,6-dihydro-1H-benzo[b][1]benzazepin-1-id-2-yl]-1,3-thiazole;bis(11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-(1-methylimidazol-2-yl)-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide);11-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-5,6-dihydro-1H-benzo[b][1]benzazepin-1-ide;platinum is sourced from PubChem (CID 158000607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).