10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc

C35H24Cl2N6O2Zn — CID 135718510

About 10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc

10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc (PubChem CID 135718510) has the molecular formula C35H24Cl2N6O2Zn and a molecular weight of 696.91 g/mol. Its IUPAC name is 10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc.

Molecular Properties

• Compound Name: 10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc
• PubChem CID: 135718510
• Molecular Formula: C35H24Cl2N6O2Zn
• Molecular Weight: 696.91 g/mol
• Exact Mass: 694.06
• IUPAC Name: 10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc
• SMILES: Cc1cccc(/N=N/c2c(O)ccc3ccccc23)n1.Oc1c(/N=N/c2ncc(Cl)cc2Cl)c2ccccc2c2ccccc12.[Zn]
• InChI: InChI=1S/C19H11Cl2N3O.C16H13N3O.Zn/c20-11-9-16(21)19(22-10-11)24-23-17-14-7-3-1-5-12(14)13-6-2-4-8-15(13)18(17)25;1-11-5-4-8-15(17-11)18-19-16-13-7-3-2-6-12(13)9-10-14(16)20;/h1-10,25H;2-10,20H,1H3;/b24-23+;19-18+
• InChIKey: OBQIPTXIEJQKKC-GNJWUISSSA-N
• XLogP: 11.48
• TPSA: 115.68 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 4
• Heavy Atoms: 46
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	696.91
LogP ≤ 5	11.48
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc?

The IUPAC name of 10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc (CID 135718510) is 10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc.

What is the SMILES notation for 10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc?

The canonical SMILES for 10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc is Cc1cccc(/N=N/c2c(O)ccc3ccccc23)n1.Oc1c(/N=N/c2ncc(Cl)cc2Cl)c2ccccc2c2ccccc12.[Zn].

What is the InChIKey of 10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc?

The InChIKey is OBQIPTXIEJQKKC-GNJWUISSSA-N. The full InChI is InChI=1S/C19H11Cl2N3O.C16H13N3O.Zn/c20-11-9-16(21)19(22-10-11)24-23-17-14-7-3-1-5-12(14)13-6-2-4-8-15(13)18(17)25;1-11-5-4-8-15(17-11)18-19-16-13-7-3-2-6-12(13)9-10-14(16)20;/h1-10,25H;2-10,20H,1H3;/b24-23+;19-18+;.

What are the key properties of 10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc?

10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc has a molecular weight of 696.91 g/mol, XLogP of 11.48, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 10-[(3,5-dichloro-2-pyridinyl)diazenyl]phenanthren-9-ol;1-[(6-methyl-2-pyridinyl)diazenyl]naphthalen-2-ol;zinc is sourced from PubChem (CID 135718510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).