2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+)

C37H32N6O2Pt — CID 153413630

About 2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+)

2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+) (PubChem CID 153413630) has the molecular formula C37H32N6O2Pt and a molecular weight of 787.78 g/mol. Its IUPAC name is 2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+).

Molecular Properties

• Compound Name: 2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+)
• PubChem CID: 153413630
• Molecular Formula: C37H32N6O2Pt
• Molecular Weight: 787.78 g/mol
• Exact Mass: 787.22
• IUPAC Name: 2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+)
• SMILES: COc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(N(C)C)cccc6N(C)C)cn5)ccc4)ccc3c3ccccc32)c1.[Pt+2]
• InChI: InChI=1S/C37H32N6O2.Pt/c1-40(2)33-14-9-15-34(41(3)4)37(33)25-23-39-42(24-25)26-10-8-11-28(20-26)45-29-16-17-31-30-12-6-7-13-32(30)43(35(31)21-29)36-22-27(44-5)18-19-38-36;/h6-19,22-24H,1-5H3;/q-2;+2
• InChIKey: KJEHWGBOYZBUBG-UHFFFAOYSA-N
• XLogP: 7.56
• TPSA: 60.58 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 8
• Heavy Atoms: 46
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	787.78
LogP ≤ 5	7.56
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+)?

The IUPAC name of 2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+) (CID 153413630) is 2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+).

What is the SMILES notation for 2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+)?

The canonical SMILES for 2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+) is COc1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5cc(-c6c(N(C)C)cccc6N(C)C)cn5)ccc4)ccc3c3ccccc32)c1.[Pt+2].

What is the InChIKey of 2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+)?

The InChIKey is KJEHWGBOYZBUBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H32N6O2.Pt/c1-40(2)33-14-9-15-34(41(3)4)37(33)25-23-39-42(24-25)26-10-8-11-28(20-26)45-29-16-17-31-30-12-6-7-13-32(30)43(35(31)21-29)36-22-27(44-5)18-19-38-36;/h6-19,22-24H,1-5H3;/q-2;+2.

What are the key properties of 2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+)?

2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+) has a molecular weight of 787.78 g/mol, XLogP of 7.56, 8 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-[3-[[9-(4-methoxy-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]pyrazol-4-yl]-1-N,1-N,3-N,3-N-tetramethylbenzene-1,3-diamine;platinum(2+) is sourced from PubChem (CID 153413630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).