(4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+)

C43H49N3O2Pt — CID 170935611

About (4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+)

(4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+) (PubChem CID 170935611) has the molecular formula C43H49N3O2Pt and a molecular weight of 834.96 g/mol. Its IUPAC name is (4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+).

Molecular Properties

• Compound Name: (4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+)
• PubChem CID: 170935611
• Molecular Formula: C43H49N3O2Pt
• Molecular Weight: 834.96 g/mol
• Exact Mass: 834.35
• IUPAC Name: (4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+)
• SMILES: Cc1cc(Oc2[c-]c(C3=N[C@](C)(C4CCCCC4)CO3)cc(C(C)(C)C)c2)[c-]c(-n2c3ccc(C(C)(C)C)cc3c3c(C)ccnc32)c1.[Pt+2]
• InChI: InChI=1S/C43H49N3O2.Pt/c1-27-19-33(46-37-16-15-31(41(3,4)5)24-36(37)38-28(2)17-18-44-39(38)46)25-34(20-27)48-35-22-29(21-32(23-35)42(6,7)8)40-45-43(9,26-47-40)30-13-11-10-12-14-30;/h15-21,23-24,30H,10-14,26H2,1-9H3;/q-2;+2/t43-;/m0./s1
• InChIKey: KBVIUUYDJNCREJ-SXWPEPABSA-N
• XLogP: 10.90
• TPSA: 48.64 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 49
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	834.96
LogP ≤ 5	10.90
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+)?

The IUPAC name of (4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+) (CID 170935611) is (4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+).

What is the SMILES notation for (4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+)?

The canonical SMILES for (4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+) is Cc1cc(Oc2[c-]c(C3=N[C@](C)(C4CCCCC4)CO3)cc(C(C)(C)C)c2)[c-]c(-n2c3ccc(C(C)(C)C)cc3c3c(C)ccnc32)c1.[Pt+2].

What is the InChIKey of (4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+)?

The InChIKey is KBVIUUYDJNCREJ-SXWPEPABSA-N. The full InChI is InChI=1S/C43H49N3O2.Pt/c1-27-19-33(46-37-16-15-31(41(3,4)5)24-36(37)38-28(2)17-18-44-39(38)46)25-34(20-27)48-35-22-29(21-32(23-35)42(6,7)8)40-45-43(9,26-47-40)30-13-11-10-12-14-30;/h15-21,23-24,30H,10-14,26H2,1-9H3;/q-2;+2/t43-;/m0./s1.

What are the key properties of (4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+)?

(4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+) has a molecular weight of 834.96 g/mol, XLogP of 10.90, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for (4R)-2-[3-tert-butyl-5-[3-(6-tert-butyl-4-methylpyrido[2,3-b]indol-9-yl)-5-methylbenzene-2-id-1-yl]oxybenzene-6-id-1-yl]-4-cyclohexyl-4-methyl-5H-1,3-oxazole;platinum(2+) is sourced from PubChem (CID 170935611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).