(3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+)

C38H30N4OPt — CID 170933834

About (3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+)

(3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+) (PubChem CID 170933834) has the molecular formula C38H30N4OPt and a molecular weight of 753.76 g/mol. Its IUPAC name is (3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+).

Molecular Properties

• Compound Name: (3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+)
• PubChem CID: 170933834
• Molecular Formula: C38H30N4OPt
• Molecular Weight: 753.76 g/mol
• Exact Mass: 753.21
• IUPAC Name: (3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+)
• SMILES: Cc1cc(C2=N[C@@H]3CCC[C@@H]3O2)[c-]c(-n2c3[c-]c(-n4c5ccc(C)cc5c5cccnc54)ccc3c3cc(C)ccc32)c1.[Pt+2]
• InChI: InChI=1S/C38H30N4O.Pt/c1-22-9-13-33-30(18-22)28-12-11-26(42-34-14-10-23(2)19-31(34)29-6-5-15-39-37(29)42)21-35(28)41(33)27-17-24(3)16-25(20-27)38-40-32-7-4-8-36(32)43-38;/h5-6,9-19,32,36H,4,7-8H2,1-3H3;/q-2;+2/t32-,36+;/m1./s1
• InChIKey: MWWPMXBIUOVUMJ-HCZDNSPVSA-N
• XLogP: 8.50
• TPSA: 44.34 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 44
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	753.76
LogP ≤ 5	8.50
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 (3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+)?

The IUPAC name of (3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+) (CID 170933834) is (3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+).

What is the SMILES notation for (3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+)?

The canonical SMILES for (3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+) is Cc1cc(C2=N[C@@H]3CCC[C@@H]3O2)[c-]c(-n2c3[c-]c(-n4c5ccc(C)cc5c5cccnc54)ccc3c3cc(C)ccc32)c1.[Pt+2].

What is the InChIKey of (3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+)?

The InChIKey is MWWPMXBIUOVUMJ-HCZDNSPVSA-N. The full InChI is InChI=1S/C38H30N4O.Pt/c1-22-9-13-33-30(18-22)28-12-11-26(42-34-14-10-23(2)19-31(34)29-6-5-15-39-37(29)42)21-35(28)41(33)27-17-24(3)16-25(20-27)38-40-32-7-4-8-36(32)43-38;/h5-6,9-19,32,36H,4,7-8H2,1-3H3;/q-2;+2/t32-,36+;/m1./s1.

What are the key properties of (3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+)?

(3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+) has a molecular weight of 753.76 g/mol, XLogP of 8.50, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for (3aR,6aS)-2-[3-methyl-5-[6-methyl-2-(6-methylpyrido[2,3-b]indol-9-yl)-1H-carbazol-1-id-9-yl]benzene-6-id-1-yl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazole;platinum(2+) is sourced from PubChem (CID 170933834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).