2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+))

C81H68N10O4Pt2 — CID 157138506

About 2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+))

2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+)) (PubChem CID 157138506) has the molecular formula C81H68N10O4Pt2 and a molecular weight of 1635.66 g/mol. Its IUPAC name is 2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+)).

Molecular Properties

• Compound Name: 2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+))
• PubChem CID: 157138506
• Molecular Formula: C81H68N10O4Pt2
• Molecular Weight: 1635.66 g/mol
• Exact Mass: 1634.47
• IUPAC Name: 2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+))
• SMILES: Cc1cccc(C)c1-n1c(C)nnc1-c1[c-]c(Oc2[c-]c3c(cc2)Oc2ccccc2N3c2cc(CC(C)(C)C)ccn2)ccc1.Cc1ccnc(N2c3[c-]c(Oc4[c-]c(-c5nnc(-c6ccccc6C)n5-c5c(C)cc(C)cc5C)ccc4)ccc3Oc3ccccc32)c1.[Pt+2].[Pt+2]
• InChI: InChI=1S/C42H33N5O2.C39H35N5O2.2Pt/c1-26-19-20-43-39(23-26)46-35-15-8-9-16-37(35)49-38-18-17-33(25-36(38)46)48-32-13-10-12-31(24-32)41-44-45-42(34-14-7-6-11-28(34)3)47(41)40-29(4)21-27(2)22-30(40)5;1-25-11-9-12-26(2)37(25)43-27(3)41-42-38(43)29-13-10-14-30(22-29)45-31-17-18-35-33(23-31)44(32-15-7-8-16-34(32)46-35)36-21-28(19-20-40-36)24-39(4,5)6;;/h6-23H,1-5H3;7-21H,24H2,1-6H3;;/q2*-2;2*+2
• InChIKey: SRJHJEACGGEBLH-UHFFFAOYSA-N
• XLogP: 20.31
• TPSA: 130.60 Ų
• H-Bond Acceptors: 14
• Rotatable Bonds: 12
• Heavy Atoms: 97
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1635.66
LogP ≤ 5	20.31
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+))?

The IUPAC name of 2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+)) (CID 157138506) is 2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+)).

What is the SMILES notation for 2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+))?

The canonical SMILES for 2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+)) is Cc1cccc(C)c1-n1c(C)nnc1-c1[c-]c(Oc2[c-]c3c(cc2)Oc2ccccc2N3c2cc(CC(C)(C)C)ccn2)ccc1.Cc1ccnc(N2c3[c-]c(Oc4[c-]c(-c5nnc(-c6ccccc6C)n5-c5c(C)cc(C)cc5C)ccc4)ccc3Oc3ccccc32)c1.[Pt+2].[Pt+2].

What is the InChIKey of 2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+))?

The InChIKey is SRJHJEACGGEBLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H33N5O2.C39H35N5O2.2Pt/c1-26-19-20-43-39(23-26)46-35-15-8-9-16-37(35)49-38-18-17-33(25-36(38)46)48-32-13-10-12-31(24-32)41-44-45-42(34-14-7-6-11-28(34)3)47(41)40-29(4)21-27(2)22-30(40)5;1-25-11-9-12-26(2)37(25)43-27(3)41-42-38(43)29-13-10-14-30(22-29)45-31-17-18-35-33(23-31)44(32-15-7-8-16-34(32)46-35)36-21-28(19-20-40-36)24-39(4,5)6;;/h6-23H,1-5H3;7-21H,24H2,1-6H3;;/q2*-2;2*+2.

What are the key properties of 2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+))?

2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+)) has a molecular weight of 1635.66 g/mol, XLogP of 20.31, 12 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[4-(2,6-dimethylphenyl)-5-methyl-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-[4-(2,2-dimethylpropyl)-2-pyridinyl]-1H-phenoxazin-1-ide;2-[3-[5-(2-methylphenyl)-4-(2,4,6-trimethylphenyl)-1,2,4-triazol-3-yl]benzene-2-id-1-yl]oxy-10-(4-methyl-2-pyridinyl)-1H-phenoxazin-1-ide;bis(platinum(2+)) is sourced from PubChem (CID 157138506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).