2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol

C19H15NO3 — CID 136986970

IUPAC2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol
SMILESO/N=C(/c1ccccc1O)c1cc(-c2ccccc2)ccc1O
InChIInChI=1S/C19H15NO3/c21-17-9-5-4-8-15(17)19(20-23)16-12-14(10-11-18(16)22)13-6-2-1-3-7-13/h1-12,21-23H/b20-19-
InChIKeyVRNQEKRAVGJKQB-VXPUYCOJSA-N
MW305.33 g/mol
LogP3.99
Rot. Bonds3

About 2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol

2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol (PubChem CID 136986970) has the molecular formula C19H15NO3 and a molecular weight of 305.33 g/mol. Its IUPAC name is 2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol.

Molecular Properties

Compound Name2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol
PubChem CID136986970
Molecular FormulaC19H15NO3
Molecular Weight305.33 g/mol
Exact Mass305.11
IUPAC Name2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol
SMILESO/N=C(/c1ccccc1O)c1cc(-c2ccccc2)ccc1O
InChIInChI=1S/C19H15NO3/c21-17-9-5-4-8-15(17)19(20-23)16-12-14(10-11-18(16)22)13-6-2-1-3-7-13/h1-12,21-23H/b20-19-
InChIKeyVRNQEKRAVGJKQB-VXPUYCOJSA-N
XLogP3.99
TPSA73.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.33
LogP ≤ 53.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol?
The IUPAC name of 2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol (CID 136986970) is 2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol.
What is the SMILES notation for 2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol?
The canonical SMILES for 2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol is O/N=C(/c1ccccc1O)c1cc(-c2ccccc2)ccc1O.
What is the InChIKey of 2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol?
The InChIKey is VRNQEKRAVGJKQB-VXPUYCOJSA-N. The full InChI is InChI=1S/C19H15NO3/c21-17-9-5-4-8-15(17)19(20-23)16-12-14(10-11-18(16)22)13-6-2-1-3-7-13/h1-12,21-23H/b20-19-.
What are the key properties of 2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol?
2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol has a molecular weight of 305.33 g/mol, XLogP of 3.99, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-N-hydroxy-C-(2-hydroxyphenyl)carbonimidoyl]-4-phenylphenol is sourced from PubChem (CID 136986970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).