7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium

C20H14N3O3S+ — CID 54676570

IUPAC7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium
SMILESCOc1ccc(-n2c(=O)c([N+]#N)c(O)c3sc(-c4ccccc4)cc32)cc1
InChIInChI=1S/C20H13N3O3S/c1-26-14-9-7-13(8-10-14)23-15-11-16(12-5-3-2-4-6-12)27-19(15)18(24)17(22-21)20(23)25/h2-11H,1H3/p+1
InChIKeyHBYMTHXFHXIKKP-UHFFFAOYSA-O
MW376.42 g/mol
LogP4.92
Rot. Bonds3

About 7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium

7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium (PubChem CID 54676570) has the molecular formula C20H14N3O3S+ and a molecular weight of 376.42 g/mol. Its IUPAC name is 7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium.

Molecular Properties

Compound Name7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium
PubChem CID54676570
Molecular FormulaC20H14N3O3S+
Molecular Weight376.42 g/mol
Exact Mass376.08
IUPAC Name7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium
SMILESCOc1ccc(-n2c(=O)c([N+]#N)c(O)c3sc(-c4ccccc4)cc32)cc1
InChIInChI=1S/C20H13N3O3S/c1-26-14-9-7-13(8-10-14)23-15-11-16(12-5-3-2-4-6-12)27-19(15)18(24)17(22-21)20(23)25/h2-11H,1H3/p+1
InChIKeyHBYMTHXFHXIKKP-UHFFFAOYSA-O
XLogP4.92
TPSA79.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium 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

2-(4-bromophenyl)-7-hydroxy-5-oxo-4-phenylthieno[3,2-b]pyridine-6-diazonium
CID 54688305
3-hydroxy-1-(4-methoxyphenyl)quinolin-2-one
CID 140970646
3-(4-methoxyphenyl)-2-phenylquinazolin-4-one
CID 708934
2-amino-3-(4-methoxyphenyl)quinazolin-4-one
CID 71652488
5-(4-methoxyphenyl)-1,6-diphenylpyrazolo[5,4-d]pyrimidin-4-one
CID 67281727
3-(4-methoxyphenyl)-2-methyl-7-phenylthieno[3,2-d]pyrimidin-4-one
CID 78322694
methyl 2-[4-(2,4-dioxo-6-phenyl-1H-thieno[3,2-d]pyrimidin-3-yl)phenyl]acetate
CID 138991665
3-(4-methoxyphenyl)-2-phenyl-5-phenyldiazenylimidazol-4-ol
CID 135837228
methyl 4-methyl-5-oxo-2-phenylthieno[3,2-b]pyridine-7-carboxylate
CID 10780490
ethyl 3-(4-methoxyphenyl)-5-methyl-2-phenylimidazole-4-carboxylate
CID 132502510
3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-phenyl-1,2,4-triazole
CID 102231682
N,3-bis(4-methoxyphenyl)-4-phenyl-1,3-thiazol-2-imine
CID 3743621

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium?
The IUPAC name of 7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium (CID 54676570) is 7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium.
What is the SMILES notation for 7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium?
The canonical SMILES for 7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium is COc1ccc(-n2c(=O)c([N+]#N)c(O)c3sc(-c4ccccc4)cc32)cc1.
What is the InChIKey of 7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium?
The InChIKey is HBYMTHXFHXIKKP-UHFFFAOYSA-O. The full InChI is InChI=1S/C20H13N3O3S/c1-26-14-9-7-13(8-10-14)23-15-11-16(12-5-3-2-4-6-12)27-19(15)18(24)17(22-21)20(23)25/h2-11H,1H3/p+1.
What are the key properties of 7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium?
7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium has a molecular weight of 376.42 g/mol, XLogP of 4.92, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-4-(4-methoxyphenyl)-5-oxo-2-phenylthieno[3,2-b]pyridine-6-diazonium is sourced from PubChem (CID 54676570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).