[(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene

C20H18N4O — CID 54206769

IUPAC[(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene
SMILESCOc1ccc(C(/N=N/c2ccccc2)/N=N/c2ccccc2)cc1
InChIInChI=1S/C20H18N4O/c1-25-19-14-12-16(13-15-19)20(23-21-17-8-4-2-5-9-17)24-22-18-10-6-3-7-11-18/h2-15,20H,1H3/b23-21+,24-22+
InChIKeyPTAQYHAWESDABA-MBALSZOMSA-N
MW330.39 g/mol
LogP6.26
Rot. Bonds6

About [(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene

[(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene (PubChem CID 54206769) has the molecular formula C20H18N4O and a molecular weight of 330.39 g/mol. Its IUPAC name is [(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene.

Molecular Properties

Compound Name[(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene
PubChem CID54206769
Molecular FormulaC20H18N4O
Molecular Weight330.39 g/mol
Exact Mass330.15
IUPAC Name[(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene
SMILESCOc1ccc(C(/N=N/c2ccccc2)/N=N/c2ccccc2)cc1
InChIInChI=1S/C20H18N4O/c1-25-19-14-12-16(13-15-19)20(23-21-17-8-4-2-5-9-17)24-22-18-10-6-3-7-11-18/h2-15,20H,1H3/b23-21+,24-22+
InChIKeyPTAQYHAWESDABA-MBALSZOMSA-N
XLogP6.26
TPSA58.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.39
LogP ≤ 56.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze [(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[bis[4-[(4-methoxyphenyl)-phenylmethyl]phenyl]methyl]-4-methoxybenzene
CID 70877905
(4-methoxyphenyl)-(5-phenyldiazenyl-1H-pyrrol-2-yl)diazene
CID 136721271
[[(4-methoxyphenyl)diazenyl]-phenyldiazenylazaniumylidene]azanide
CID 142763484
[4-[10-(4-methoxyphenoxy)decoxy]phenyl]-phenyldiazene
CID 71420351
2-(3-methoxyphenyl)-2-phenyldiazenylethanamine
CID 57113808
1-[bis(4-methoxyphenyl)methyl]-4-phenylbenzene
CID 134976312
(4-methoxyphenyl)-methyldiazene
CID 20589170
(4-methoxyphenyl)iminovanadium;tris((1R)-1-phenylethanol)
CID 177409236
(4-methoxyphenyl)-naphthalen-2-yldiazene
CID 572318
[chloro(pyridin-4-yl)methyl]-(4-methoxyphenyl)diazene
CID 123297169
CID 172685187
CID 172685187
anisole;trihydrofluoride
CID 174796385

Frequently Asked Questions

What is the IUPAC name of [(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene?
The IUPAC name of [(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene (CID 54206769) is [(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene.
What is the SMILES notation for [(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene?
The canonical SMILES for [(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene is COc1ccc(C(/N=N/c2ccccc2)/N=N/c2ccccc2)cc1.
What is the InChIKey of [(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene?
The InChIKey is PTAQYHAWESDABA-MBALSZOMSA-N. The full InChI is InChI=1S/C20H18N4O/c1-25-19-14-12-16(13-15-19)20(23-21-17-8-4-2-5-9-17)24-22-18-10-6-3-7-11-18/h2-15,20H,1H3/b23-21+,24-22+.
What are the key properties of [(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene?
[(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene has a molecular weight of 330.39 g/mol, XLogP of 6.26, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-methoxyphenyl)-phenyldiazenylmethyl]-phenyldiazene is sourced from PubChem (CID 54206769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).