tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide

C99H60N18O3Pt3 — CID 159355089

About tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide

tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide (PubChem CID 159355089) has the molecular formula C99H60N18O3Pt3 and a molecular weight of 2134.93 g/mol. Its IUPAC name is tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide.

Molecular Properties

• Compound Name: tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide
• PubChem CID: 159355089
• Molecular Formula: C99H60N18O3Pt3
• Molecular Weight: 2134.93 g/mol
• Exact Mass: 2133.40
• IUPAC Name: tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide
• SMILES: [Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)cccc1-n1ncc2c1ccn2-c1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)cccc1-n1ncc2c1ccn2-c1cccnc1.[c-]1c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)cccc1-n1ncc2c1ccn2-c1ccncc1
• InChI: InChI=1S/3C33H20N6O.3Pt/c1-2-11-28-26(10-1)27-15-14-25(21-30(27)38(28)33-13-4-6-18-35-33)40-24-9-7-8-23(20-24)39-29-16-19-37(31(29)22-36-39)32-12-3-5-17-34-32;1-2-11-29-27(10-1)28-14-13-26(20-31(28)38(29)33-12-3-4-17-35-33)40-25-9-5-7-23(19-25)39-30-15-18-37(32(30)22-36-39)24-8-6-16-34-21-24;1-2-9-29-27(8-1)28-12-11-26(21-31(28)38(29)33-10-3-4-16-35-33)40-25-7-5-6-24(20-25)39-30-15-19-37(32(30)22-36-39)23-13-17-34-18-14-23;;;/h1-19,22H;1-18,21-22H;1-19,22H;;;/q3*-2;3*+2
• InChIKey: IOGPASXRHWBPPS-UHFFFAOYSA-N
• XLogP: 21.28
• TPSA: 188.07 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 15
• Heavy Atoms: 123
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2134.93
LogP ≤ 5	21.28
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide?

The IUPAC name of tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide (CID 159355089) is tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide.

What is the SMILES notation for tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide?

The canonical SMILES for tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide is [Pt+2].[Pt+2].[Pt+2].[c-]1c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)cccc1-n1ncc2c1ccn2-c1ccccn1.[c-]1c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)cccc1-n1ncc2c1ccn2-c1cccnc1.[c-]1c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2ccccn2)cccc1-n1ncc2c1ccn2-c1ccncc1.

What is the InChIKey of tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide?

The InChIKey is IOGPASXRHWBPPS-UHFFFAOYSA-N. The full InChI is InChI=1S/3C33H20N6O.3Pt/c1-2-11-28-26(10-1)27-15-14-25(21-30(27)38(28)33-13-4-6-18-35-33)40-24-9-7-8-23(20-24)39-29-16-19-37(31(29)22-36-39)32-12-3-5-17-34-32;1-2-11-29-27(10-1)28-14-13-26(20-31(28)38(29)33-12-3-4-17-35-33)40-25-9-5-7-23(19-25)39-30-15-18-37(32(30)22-36-39)24-8-6-16-34-21-24;1-2-9-29-27(8-1)28-12-11-26(21-31(28)38(29)33-10-3-4-16-35-33)40-25-7-5-6-24(20-25)39-30-15-19-37(32(30)22-36-39)23-13-17-34-18-14-23;;;/h1-19,22H;1-18,21-22H;1-19,22H;;;/q3*-2;3*+2.

What are the key properties of tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide?

tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide has a molecular weight of 2134.93 g/mol, XLogP of 21.28, 15 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for tris(platinum(2+));9-pyridin-2-yl-2-[3-(4-pyridin-2-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-3-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;9-pyridin-2-yl-2-[3-(4-pyridin-4-ylpyrrolo[2,3-d]pyrazol-1-yl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide is sourced from PubChem (CID 159355089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).