3-phenoxy-6-thiophen-3-ylpyridazine

C14H10N2OS — CID 155524315

IUPAC3-phenoxy-6-thiophen-3-ylpyridazine
SMILESc1ccc(Oc2ccc(-c3ccsc3)nn2)cc1
InChIInChI=1S/C14H10N2OS/c1-2-4-12(5-3-1)17-14-7-6-13(15-16-14)11-8-9-18-10-11/h1-10H
InChIKeyZRZGPFREXUARCH-UHFFFAOYSA-N
MW254.31 g/mol
LogP4.00
Rot. Bonds3

About 3-phenoxy-6-thiophen-3-ylpyridazine

3-phenoxy-6-thiophen-3-ylpyridazine (PubChem CID 155524315) has the molecular formula C14H10N2OS and a molecular weight of 254.31 g/mol. Its IUPAC name is 3-phenoxy-6-thiophen-3-ylpyridazine.

Molecular Properties

Compound Name3-phenoxy-6-thiophen-3-ylpyridazine
PubChem CID155524315
Molecular FormulaC14H10N2OS
Molecular Weight254.31 g/mol
Exact Mass254.05
IUPAC Name3-phenoxy-6-thiophen-3-ylpyridazine
SMILESc1ccc(Oc2ccc(-c3ccsc3)nn2)cc1
InChIInChI=1S/C14H10N2OS/c1-2-4-12(5-3-1)17-14-7-6-13(15-16-14)11-8-9-18-10-11/h1-10H
InChIKeyZRZGPFREXUARCH-UHFFFAOYSA-N
XLogP4.00
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.31
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-phenoxy-6-thiophen-3-ylpyridazine?
The IUPAC name of 3-phenoxy-6-thiophen-3-ylpyridazine (CID 155524315) is 3-phenoxy-6-thiophen-3-ylpyridazine.
What is the SMILES notation for 3-phenoxy-6-thiophen-3-ylpyridazine?
The canonical SMILES for 3-phenoxy-6-thiophen-3-ylpyridazine is c1ccc(Oc2ccc(-c3ccsc3)nn2)cc1.
What is the InChIKey of 3-phenoxy-6-thiophen-3-ylpyridazine?
The InChIKey is ZRZGPFREXUARCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2OS/c1-2-4-12(5-3-1)17-14-7-6-13(15-16-14)11-8-9-18-10-11/h1-10H.
What are the key properties of 3-phenoxy-6-thiophen-3-ylpyridazine?
3-phenoxy-6-thiophen-3-ylpyridazine has a molecular weight of 254.31 g/mol, XLogP of 4.00, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenoxy-6-thiophen-3-ylpyridazine is sourced from PubChem (CID 155524315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).