3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium)

C86H64N8O2Rh4S-4 — CID 161470977

About 3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium)

3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium) (PubChem CID 161470977) has the molecular formula C86H64N8O2Rh4S-4 and a molecular weight of 1685.20 g/mol. Its IUPAC name is 3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium).

Molecular Properties

• Compound Name: 3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium)
• PubChem CID: 161470977
• Molecular Formula: C86H64N8O2Rh4S-4
• Molecular Weight: 1685.20 g/mol
• Exact Mass: 1684.11
• IUPAC Name: 3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium)
• SMILES: [CH2-]c1ccccc1-c1cc(-c2ccc(-c3ccccc3)cc2)on1.[CH2-]c1ccccc1-c1nnc(-c2ccc(-c3ccccc3)cc2)n1C.[CH2-]c1ccccc1-c1nnc(-c2ccc(-c3ccccc3)cc2)o1.[CH2-]c1ccccc1-c1nnc(-c2ccc(-c3ccccc3)cc2)s1.[Rh].[Rh].[Rh].[Rh]
• InChI: InChI=1S/C22H18N3.C22H16NO.C21H15N2O.C21H15N2S.4Rh/c1-16-8-6-7-11-20(16)22-24-23-21(25(22)2)19-14-12-18(13-15-19)17-9-4-3-5-10-17;1-16-7-5-6-10-20(16)21-15-22(24-23-21)19-13-11-18(12-14-19)17-8-3-2-4-9-17;2*1-15-7-5-6-10-19(15)21-23-22-20(24-21)18-13-11-17(12-14-18)16-8-3-2-4-9-16;;;;/h3-15H,1H2,2H3;2-15H,1H2;2*2-14H,1H2;;;;/q4*-1
• InChIKey: XGCMCZKHAXHSNF-UHFFFAOYSA-N
• XLogP: 21.82
• TPSA: 121.44 Ų
• H-Bond Acceptors: 11
• Rotatable Bonds: 12
• Heavy Atoms: 101
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1685.20
LogP ≤ 5	21.82
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium)?

The IUPAC name of 3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium) (CID 161470977) is 3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium).

What is the SMILES notation for 3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium)?

The canonical SMILES for 3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium) is [CH2-]c1ccccc1-c1cc(-c2ccc(-c3ccccc3)cc2)on1.[CH2-]c1ccccc1-c1nnc(-c2ccc(-c3ccccc3)cc2)n1C.[CH2-]c1ccccc1-c1nnc(-c2ccc(-c3ccccc3)cc2)o1.[CH2-]c1ccccc1-c1nnc(-c2ccc(-c3ccccc3)cc2)s1.[Rh].[Rh].[Rh].[Rh].

What is the InChIKey of 3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium)?

The InChIKey is XGCMCZKHAXHSNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N3.C22H16NO.C21H15N2O.C21H15N2S.4Rh/c1-16-8-6-7-11-20(16)22-24-23-21(25(22)2)19-14-12-18(13-15-19)17-9-4-3-5-10-17;1-16-7-5-6-10-20(16)21-15-22(24-23-21)19-13-11-18(12-14-19)17-8-3-2-4-9-17;2*1-15-7-5-6-10-19(15)21-23-22-20(24-21)18-13-11-17(12-14-18)16-8-3-2-4-9-16;;;;/h3-15H,1H2,2H3;2-15H,1H2;2*2-14H,1H2;;;;/q4*-1;;;;.

What are the key properties of 3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium)?

3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium) has a molecular weight of 1685.20 g/mol, XLogP of 21.82, 12 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(2-methanidylphenyl)-4-methyl-5-(4-phenylphenyl)-1,2,4-triazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-oxadiazole;3-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,2-oxazole;2-(2-methanidylphenyl)-5-(4-phenylphenyl)-1,3,4-thiadiazole;tetrakis(rhodium) is sourced from PubChem (CID 161470977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).