4,9-dimethoxyphenazine-2,7-diol

C14H12N2O4 — CID 146380846

IUPAC4,9-dimethoxyphenazine-2,7-diol
SMILESCOc1cc(O)cc2nc3c(OC)cc(O)cc3nc12
InChIInChI=1S/C14H12N2O4/c1-19-11-5-7(17)3-9-13(11)15-10-4-8(18)6-12(20-2)14(10)16-9/h3-6,17-18H,1-2H3
InChIKeyCGKGATHBRYDYDY-UHFFFAOYSA-N
MW272.26 g/mol
LogP2.21
Rot. Bonds2

About 4,9-dimethoxyphenazine-2,7-diol

4,9-dimethoxyphenazine-2,7-diol (PubChem CID 146380846) has the molecular formula C14H12N2O4 and a molecular weight of 272.26 g/mol. Its IUPAC name is 4,9-dimethoxyphenazine-2,7-diol.

Molecular Properties

Compound Name4,9-dimethoxyphenazine-2,7-diol
PubChem CID146380846
Molecular FormulaC14H12N2O4
Molecular Weight272.26 g/mol
Exact Mass272.08
IUPAC Name4,9-dimethoxyphenazine-2,7-diol
SMILESCOc1cc(O)cc2nc3c(OC)cc(O)cc3nc12
InChIInChI=1S/C14H12N2O4/c1-19-11-5-7(17)3-9-13(11)15-10-4-8(18)6-12(20-2)14(10)16-9/h3-6,17-18H,1-2H3
InChIKeyCGKGATHBRYDYDY-UHFFFAOYSA-N
XLogP2.21
TPSA84.70 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

7-hydroxy-9-methoxyphenazine-2-sulfonic acid
CID 146386121
ethane;8-hydroxy-6-methoxyphenazine-2-sulfonic acid
CID 156832576
7-hydroxy-9-methoxy-3-methylphenazine-2-sulfonic acid;6-methoxy-3,8-dimethylphenazine-2-sulfonic acid
CID 162245752
4,9-dimethoxyphenazine-2,7-dicarboxylic acid
CID 146380937
2-bromo-4-methoxy-1,3-benzothiazol-6-ol
CID 135157042
8-(dihydroxymethyl)-6-methoxyphenazine-2,3-diol
CID 166717796
4-bromo-3,5-dimethoxyphenol
CID 14339099
4-(4-hydroxy-2,6-dimethoxyphenyl)sulfanyl-3,5-dimethoxyphenol
CID 14993626
4-chloro-5-methoxybenzene-1,3-diol
CID 130033872
3-fluoro-5-methoxy-4-methylphenol
CID 84650327
3-chloro-8-fluoro-1-methoxyphenazine
CID 172853505
2-bromo-8-chloro-6-methoxy-1-methylphenazine
CID 172864583

Frequently Asked Questions

What is the IUPAC name of 4,9-dimethoxyphenazine-2,7-diol?
The IUPAC name of 4,9-dimethoxyphenazine-2,7-diol (CID 146380846) is 4,9-dimethoxyphenazine-2,7-diol.
What is the SMILES notation for 4,9-dimethoxyphenazine-2,7-diol?
The canonical SMILES for 4,9-dimethoxyphenazine-2,7-diol is COc1cc(O)cc2nc3c(OC)cc(O)cc3nc12.
What is the InChIKey of 4,9-dimethoxyphenazine-2,7-diol?
The InChIKey is CGKGATHBRYDYDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O4/c1-19-11-5-7(17)3-9-13(11)15-10-4-8(18)6-12(20-2)14(10)16-9/h3-6,17-18H,1-2H3.
What are the key properties of 4,9-dimethoxyphenazine-2,7-diol?
4,9-dimethoxyphenazine-2,7-diol has a molecular weight of 272.26 g/mol, XLogP of 2.21, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,9-dimethoxyphenazine-2,7-diol is sourced from PubChem (CID 146380846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).