10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+))

C120H90N16O6Pt4S2-6 — CID 158337400

About 10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+))

10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+)) (PubChem CID 158337400) has the molecular formula C120H90N16O6Pt4S2-6 and a molecular weight of 2696.59 g/mol. Its IUPAC name is 10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+)).

Molecular Properties

• Compound Name: 10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+))
• PubChem CID: 158337400
• Molecular Formula: C120H90N16O6Pt4S2-6
• Molecular Weight: 2696.59 g/mol
• Exact Mass: 2694.53
• IUPAC Name: 10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+))
• SMILES: CC(C)(C)c1ccnc(N2c3[c-]c(Oc4[c-]c(-n5cccn5)ccc4)ccc3Oc3ccccc32)c1.CN1C=CN(c2[c-]c(Oc3[c-]c4c(cc3)Sc3ccccc3N4c3cc(C(C)(C)C)ccn3)ccc2)[CH-]1.CN1C=CN(c2[c-]c(Oc3[c-]c4c(cc3)Sc3ccccc3N4c3ccccn3)ccc2)[CH-]1.[Pt+2].[Pt+2].[Pt].[Pt].[c-]1c(Oc2[c-]c3c(cc2)Oc2ccccc2N3c2ccccn2)cccc1-n1cc(-c2ccccc2)cn1
• InChI: InChI=1S/C32H20N4O2.C31H27N4OS.C30H24N4O2.C27H19N4OS.4Pt/c1-2-9-23(10-3-1)24-21-34-35(22-24)25-11-8-12-26(19-25)37-27-16-17-31-29(20-27)36(32-15-6-7-18-33-32)28-13-4-5-14-30(28)38-31;1-31(2,3)22-14-15-32-30(18-22)35-26-10-5-6-11-28(26)37-29-13-12-25(20-27(29)35)36-24-9-7-8-23(19-24)34-17-16-33(4)21-34;1-30(2,3)21-14-16-31-29(18-21)34-25-10-4-5-11-27(25)36-28-13-12-24(20-26(28)34)35-23-9-6-8-22(19-23)33-17-7-15-32-33;1-29-15-16-30(19-29)20-7-6-8-21(17-20)32-22-12-13-26-24(18-22)31(27-11-4-5-14-28-27)23-9-2-3-10-25(23)33-26;;;;/h1-18,21-22H;5-18,21H,1-4H3;4-18H,1-3H3;2-16,19H,1H3;;;;/q-2;-3;-2;-3;;;2*+2
• InChIKey: HWWKLTUANCSDSU-UHFFFAOYSA-N
• XLogP: 30.22
• TPSA: 168.50 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 17
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2696.59
LogP ≤ 5	30.22
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+))?

The IUPAC name of 10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+)) (CID 158337400) is 10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+)).

What is the SMILES notation for 10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+))?

The canonical SMILES for 10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+)) is CC(C)(C)c1ccnc(N2c3[c-]c(Oc4[c-]c(-n5cccn5)ccc4)ccc3Oc3ccccc32)c1.CN1C=CN(c2[c-]c(Oc3[c-]c4c(cc3)Sc3ccccc3N4c3cc(C(C)(C)C)ccn3)ccc2)[CH-]1.CN1C=CN(c2[c-]c(Oc3[c-]c4c(cc3)Sc3ccccc3N4c3ccccn3)ccc2)[CH-]1.[Pt+2].[Pt+2].[Pt].[Pt].[c-]1c(Oc2[c-]c3c(cc2)Oc2ccccc2N3c2ccccn2)cccc1-n1cc(-c2ccccc2)cn1.

What is the InChIKey of 10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+))?

The InChIKey is HWWKLTUANCSDSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H20N4O2.C31H27N4OS.C30H24N4O2.C27H19N4OS.4Pt/c1-2-9-23(10-3-1)24-21-34-35(22-24)25-11-8-12-26(19-25)37-27-16-17-31-29(20-27)36(32-15-6-7-18-33-32)28-13-4-5-14-30(28)38-31;1-31(2,3)22-14-15-32-30(18-22)35-26-10-5-6-11-28(26)37-29-13-12-25(20-27(29)35)36-24-9-7-8-23(19-24)34-17-16-33(4)21-34;1-30(2,3)21-14-16-31-29(18-21)34-25-10-4-5-11-27(25)36-28-13-12-24(20-26(28)34)35-23-9-6-8-22(19-23)33-17-7-15-32-33;1-29-15-16-30(19-29)20-7-6-8-21(17-20)32-22-12-13-26-24(18-22)31(27-11-4-5-14-28-27)23-9-2-3-10-25(23)33-26;;;;/h1-18,21-22H;5-18,21H,1-4H3;4-18H,1-3H3;2-16,19H,1H3;;;;/q-2;-3;-2;-3;;;2*+2.

What are the key properties of 10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+))?

10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+)) has a molecular weight of 2696.59 g/mol, XLogP of 30.22, 17 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 10-(4-tert-butyl-2-pyridinyl)-2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-1H-phenothiazin-1-ide;10-(4-tert-butyl-2-pyridinyl)-2-(3-pyrazol-1-ylbenzene-2-id-1-yl)oxy-1H-phenoxazin-1-ide;2-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenothiazin-1-ide;2-[3-(4-phenylpyrazol-1-yl)benzene-2-id-1-yl]oxy-10-pyridin-2-yl-1H-phenoxazin-1-ide;platinum;bis(platinum(2+)) is sourced from PubChem (CID 158337400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).