8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum

C41H36N5OPt-3 — CID 155633576

About 8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum

8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum (PubChem CID 155633576) has the molecular formula C41H36N5OPt-3 and a molecular weight of 809.85 g/mol. Its IUPAC name is 8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum.

Molecular Properties

• Compound Name: 8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum
• PubChem CID: 155633576
• Molecular Formula: C41H36N5OPt-3
• Molecular Weight: 809.85 g/mol
• Exact Mass: 809.26
• IUPAC Name: 8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum
• SMILES: Cc1nc2c(Oc3cc(C(C)(C)C)ccn3)[c-]c(C3(c4[c-]c(N5C=CN(C)[CH-]5)ccc4)c4ccccc4-c4ccccc43)cn2c1C.[Pt]
• InChI: InChI=1S/C41H36N5O.Pt/c1-27-28(2)46-25-31(23-37(39(46)43-27)47-38-24-29(18-19-42-38)40(3,4)5)41(30-12-11-13-32(22-30)45-21-20-44(6)26-45)35-16-9-7-14-33(35)34-15-8-10-17-36(34)41;/h7-21,24-26H,1-6H3;/q-3
• InChIKey: QBRKAKACFDUSRI-UHFFFAOYSA-N
• XLogP: 8.74
• TPSA: 45.90 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 48
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	809.85
LogP ≤ 5	8.74
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum?

The IUPAC name of 8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum (CID 155633576) is 8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum.

What is the SMILES notation for 8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum?

The canonical SMILES for 8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum is Cc1nc2c(Oc3cc(C(C)(C)C)ccn3)[c-]c(C3(c4[c-]c(N5C=CN(C)[CH-]5)ccc4)c4ccccc4-c4ccccc43)cn2c1C.[Pt].

What is the InChIKey of 8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum?

The InChIKey is QBRKAKACFDUSRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H36N5O.Pt/c1-27-28(2)46-25-31(23-37(39(46)43-27)47-38-24-29(18-19-42-38)40(3,4)5)41(30-12-11-13-32(22-30)45-21-20-44(6)26-45)35-16-9-7-14-33(35)34-15-8-10-17-36(34)41;/h7-21,24-26H,1-6H3;/q-3;.

What are the key properties of 8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum?

8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum has a molecular weight of 809.85 g/mol, XLogP of 8.74, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[(4-tert-butyl-2-pyridinyl)oxy]-2,3-dimethyl-6-[9-[3-(3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]fluoren-9-yl]-7H-imidazo[1,2-a]pyridin-7-ide;platinum is sourced from PubChem (CID 155633576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).