2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum

C75H87N9OPd3PtS4-4 — CID 159519970

About 2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum

2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum (PubChem CID 159519970) has the molecular formula C75H87N9OPd3PtS4-4 and a molecular weight of 1773.19 g/mol. Its IUPAC name is 2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum.

Molecular Properties

• Compound Name: 2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum
• PubChem CID: 159519970
• Molecular Formula: C75H87N9OPd3PtS4-4
• Molecular Weight: 1773.19 g/mol
• Exact Mass: 1770.27
• IUPAC Name: 2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum
• SMILES: CC1(Cc2nc(-c3ccccc3[N-]c3ccccc3)cs2)CCCC1.CCC(c1ncc(-c2ncco2)c([S-])n1)C1(C)CCCCC1.Cc1nc(-c2cccc3c(C4(C)CCCCC4)c[n-]c23)cs1.Cn1ccnc1-c1cc(CC2(C)CCCC2)ccc1[S-].[Pd].[Pd].[Pd].[Pt]
• InChI: InChI=1S/C22H23N2S.C19H21N2S.C17H23N3OS.C17H22N2S.3Pd.Pt/c1-22(13-7-8-14-22)15-21-24-20(16-25-21)18-11-5-6-12-19(18)23-17-9-3-2-4-10-17;1-13-21-17(12-22-13)15-8-6-7-14-16(11-20-18(14)15)19(2)9-4-3-5-10-19;1-3-13(17(2)7-5-4-6-8-17)14-19-11-12(16(22)20-14)15-18-9-10-21-15;1-17(7-3-4-8-17)12-13-5-6-15(20)14(11-13)16-18-9-10-19(16)2;;;;/h2-6,9-12,16H,7-8,13-15H2,1H3;6-8,11-12H,3-5,9-10H2,1-2H3;9-11,13H,3-8H2,1-2H3,(H,19,20,22);5-6,9-11,20H,3-4,7-8,12H2,1-2H3;;;;/q2*-1;;;;;;/p-2
• InChIKey: VFUACOPCUZSOJF-UHFFFAOYSA-L
• XLogP: 21.33
• TPSA: 123.61 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 14
• Heavy Atoms: 93
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1773.19
LogP ≤ 5	21.33
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'thiol_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum?

The IUPAC name of 2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum (CID 159519970) is 2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum.

What is the SMILES notation for 2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum?

The canonical SMILES for 2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum is CC1(Cc2nc(-c3ccccc3[N-]c3ccccc3)cs2)CCCC1.CCC(c1ncc(-c2ncco2)c([S-])n1)C1(C)CCCCC1.Cc1nc(-c2cccc3c(C4(C)CCCCC4)c[n-]c23)cs1.Cn1ccnc1-c1cc(CC2(C)CCCC2)ccc1[S-].[Pd].[Pd].[Pd].[Pt].

What is the InChIKey of 2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum?

The InChIKey is VFUACOPCUZSOJF-UHFFFAOYSA-L. The full InChI is InChI=1S/C22H23N2S.C19H21N2S.C17H23N3OS.C17H22N2S.3Pd.Pt/c1-22(13-7-8-14-22)15-21-24-20(16-25-21)18-11-5-6-12-19(18)23-17-9-3-2-4-10-17;1-13-21-17(12-22-13)15-8-6-7-14-16(11-20-18(14)15)19(2)9-4-3-5-10-19;1-3-13(17(2)7-5-4-6-8-17)14-19-11-12(16(22)20-14)15-18-9-10-21-15;1-17(7-3-4-8-17)12-13-5-6-15(20)14(11-13)16-18-9-10-19(16)2;;;;/h2-6,9-12,16H,7-8,13-15H2,1H3;6-8,11-12H,3-5,9-10H2,1-2H3;9-11,13H,3-8H2,1-2H3,(H,19,20,22);5-6,9-11,20H,3-4,7-8,12H2,1-2H3;;;;/q2*-1;;;;;;/p-2.

What are the key properties of 2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum?

2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum has a molecular weight of 1773.19 g/mol, XLogP of 21.33, 14 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-(1-methylcyclohexyl)propyl]-5-(1,3-oxazol-2-yl)pyrimidine-4-thiolate;4-[(1-methylcyclopentyl)methyl]-2-(1-methylimidazol-2-yl)benzenethiolate;[2-[2-[(1-methylcyclopentyl)methyl]-1,3-thiazol-4-yl]phenyl]-phenylazanide;2-methyl-4-[3-(1-methylcyclohexyl)indol-1-id-7-yl]-1,3-thiazole;tris(palladium);platinum is sourced from PubChem (CID 159519970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).