2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide

C19H13Cl2N3O — CID 3386476

IUPAC2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide
SMILESO=C(Nc1ccc(/N=N/c2ccccc2)cc1)c1c(Cl)cccc1Cl
InChIInChI=1S/C19H13Cl2N3O/c20-16-7-4-8-17(21)18(16)19(25)22-13-9-11-15(12-10-13)24-23-14-5-2-1-3-6-14/h1-12H,(H,22,25)/b24-23+
InChIKeyIDIXVNJMDHVDDE-WCWDXBQESA-N
MW370.24 g/mol
LogP6.66
Rot. Bonds4

About 2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide

2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide (PubChem CID 3386476) has the molecular formula C19H13Cl2N3O and a molecular weight of 370.24 g/mol. Its IUPAC name is 2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide
PubChem CID3386476
Molecular FormulaC19H13Cl2N3O
Molecular Weight370.24 g/mol
Exact Mass369.04
IUPAC Name2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide
SMILESO=C(Nc1ccc(/N=N/c2ccccc2)cc1)c1c(Cl)cccc1Cl
InChIInChI=1S/C19H13Cl2N3O/c20-16-7-4-8-17(21)18(16)19(25)22-13-9-11-15(12-10-13)24-23-14-5-2-1-3-6-14/h1-12H,(H,22,25)/b24-23+
InChIKeyIDIXVNJMDHVDDE-WCWDXBQESA-N
XLogP6.66
TPSA53.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.24
LogP ≤ 56.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2,6-dichloro-N-(4-methylphenyl)benzamide
CID 5152296
1-(4-chlorophenyl)-3-(4-phenyldiazenylphenyl)urea
CID 4677729
2-[4-[(2,6-dichlorobenzoyl)amino]phenyl]propanoic acid
CID 13059785
2,2-dichloro-N-(4-phenyldiazenylphenyl)acetamide
CID 5180654
ethane;N-phenyl-4-phenyldiazenylbenzamide
CID 159586308
2,6-dichloro-N-(4-nitrophenyl)benzamide
CID 4206634
5-bromo-N-(4-phenyldiazenylphenyl)thiophene-2-carboxamide
CID 18293102
2-(4-chlorobenzoyl)-N-(4-phenyldiazenylphenyl)benzamide
CID 165365429
2,4,6-trichloro-N-phenylbenzamide
CID 68933625
1-[(2,6-dichlorobenzoyl)amino]-3-phenylurea
CID 134118825
N-[4-(4-phenyldiazenylphenyl)phenyl]acetamide
CID 2749691
2,6-dichloro-N-(6-chloro-3-pyridinyl)benzamide
CID 113247998

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide?
The IUPAC name of 2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide (CID 3386476) is 2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide.
What is the SMILES notation for 2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide?
The canonical SMILES for 2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide is O=C(Nc1ccc(/N=N/c2ccccc2)cc1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide?
The InChIKey is IDIXVNJMDHVDDE-WCWDXBQESA-N. The full InChI is InChI=1S/C19H13Cl2N3O/c20-16-7-4-8-17(21)18(16)19(25)22-13-9-11-15(12-10-13)24-23-14-5-2-1-3-6-14/h1-12H,(H,22,25)/b24-23+.
What are the key properties of 2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide?
2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide has a molecular weight of 370.24 g/mol, XLogP of 6.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(4-phenyldiazenylphenyl)benzamide is sourced from PubChem (CID 3386476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).