3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine

C19H17N3O3S — CID 155554256

IUPAC3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine
SMILESCOc1cc(-c2ccc3ncc(-c4cccs4)n3n2)cc(OC)c1OC
InChIInChI=1S/C19H17N3O3S/c1-23-15-9-12(10-16(24-2)19(15)25-3)13-6-7-18-20-11-14(22(18)21-13)17-5-4-8-26-17/h4-11H,1-3H3
InChIKeyWRJUHSMIBBVAAW-UHFFFAOYSA-N
MW367.43 g/mol
LogP4.15
Rot. Bonds5

About 3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine

3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine (PubChem CID 155554256) has the molecular formula C19H17N3O3S and a molecular weight of 367.43 g/mol. Its IUPAC name is 3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine
PubChem CID155554256
Molecular FormulaC19H17N3O3S
Molecular Weight367.43 g/mol
Exact Mass367.10
IUPAC Name3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine
SMILESCOc1cc(-c2ccc3ncc(-c4cccs4)n3n2)cc(OC)c1OC
InChIInChI=1S/C19H17N3O3S/c1-23-15-9-12(10-16(24-2)19(15)25-3)13-6-7-18-20-11-14(22(18)21-13)17-5-4-8-26-17/h4-11H,1-3H3
InChIKeyWRJUHSMIBBVAAW-UHFFFAOYSA-N
XLogP4.15
TPSA57.88 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.43
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine?
The IUPAC name of 3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine (CID 155554256) is 3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine is COc1cc(-c2ccc3ncc(-c4cccs4)n3n2)cc(OC)c1OC.
What is the InChIKey of 3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine?
The InChIKey is WRJUHSMIBBVAAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O3S/c1-23-15-9-12(10-16(24-2)19(15)25-3)13-6-7-18-20-11-14(22(18)21-13)17-5-4-8-26-17/h4-11H,1-3H3.
What are the key properties of 3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine?
3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine has a molecular weight of 367.43 g/mol, XLogP of 4.15, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-thiophen-2-yl-6-(3,4,5-trimethoxyphenyl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 155554256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).