1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine

C26H20N2 — CID 146413407

IUPAC1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine
SMILESNN(c1ccc(-c2ccccc2)cc1)c1cc2ccccc2c2ccccc12
InChIInChI=1S/C26H20N2/c27-28(22-16-14-20(15-17-22)19-8-2-1-3-9-19)26-18-21-10-4-5-11-23(21)24-12-6-7-13-25(24)26/h1-18H,27H2
InChIKeyDOBQFRXKWBBEEP-UHFFFAOYSA-N
MW360.46 g/mol
LogP6.67
Rot. Bonds3

About 1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine

1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine (PubChem CID 146413407) has the molecular formula C26H20N2 and a molecular weight of 360.46 g/mol. Its IUPAC name is 1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine.

Molecular Properties

Compound Name1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine
PubChem CID146413407
Molecular FormulaC26H20N2
Molecular Weight360.46 g/mol
Exact Mass360.16
IUPAC Name1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine
SMILESNN(c1ccc(-c2ccccc2)cc1)c1cc2ccccc2c2ccccc12
InChIInChI=1S/C26H20N2/c27-28(22-16-14-20(15-17-22)19-8-2-1-3-9-19)26-18-21-10-4-5-11-23(21)24-12-6-7-13-25(24)26/h1-18H,27H2
InChIKeyDOBQFRXKWBBEEP-UHFFFAOYSA-N
XLogP6.67
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.46
LogP ≤ 56.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine?
The IUPAC name of 1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine (CID 146413407) is 1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine.
What is the SMILES notation for 1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine?
The canonical SMILES for 1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine is NN(c1ccc(-c2ccccc2)cc1)c1cc2ccccc2c2ccccc12.
What is the InChIKey of 1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine?
The InChIKey is DOBQFRXKWBBEEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N2/c27-28(22-16-14-20(15-17-22)19-8-2-1-3-9-19)26-18-21-10-4-5-11-23(21)24-12-6-7-13-25(24)26/h1-18H,27H2.
What are the key properties of 1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine?
1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine has a molecular weight of 360.46 g/mol, XLogP of 6.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenanthren-9-yl-1-(4-phenylphenyl)hydrazine is sourced from PubChem (CID 146413407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).