6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine

C19H15N3OS — CID 10568650

IUPAC6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine
SMILESCOc1cccc(Sc2ccc3nc(-c4ccccc4)cn3n2)c1
InChIInChI=1S/C19H15N3OS/c1-23-15-8-5-9-16(12-15)24-19-11-10-18-20-17(13-22(18)21-19)14-6-3-2-4-7-14/h2-13H,1H3
InChIKeyDYYNIOFIHVVBSY-UHFFFAOYSA-N
MW333.42 g/mol
LogP4.56
Rot. Bonds4

About 6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine

6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine (PubChem CID 10568650) has the molecular formula C19H15N3OS and a molecular weight of 333.42 g/mol. Its IUPAC name is 6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine
PubChem CID10568650
Molecular FormulaC19H15N3OS
Molecular Weight333.42 g/mol
Exact Mass333.09
IUPAC Name6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine
SMILESCOc1cccc(Sc2ccc3nc(-c4ccccc4)cn3n2)c1
InChIInChI=1S/C19H15N3OS/c1-23-15-8-5-9-16(12-15)24-19-11-10-18-20-17(13-22(18)21-19)14-6-3-2-4-7-14/h2-13H,1H3
InChIKeyDYYNIOFIHVVBSY-UHFFFAOYSA-N
XLogP4.56
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.42
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazine
CID 15750003
1-[6-(3-methoxyphenyl)sulfanylimidazo[1,2-b]pyridazin-2-yl]-3-methylurea
CID 58243191
6-(3-methoxyphenyl)sulfanyl-2H-[1,2,4]triazolo[4,3-b]pyridazin-3-one
CID 166632548
6-(3-methoxyphenyl)-N-methylimidazo[1,2-b]pyridazin-2-amine
CID 143879206
6-chloro-2-(4-phenylphenyl)imidazo[1,2-b]pyridazine
CID 15032578
2-(1,3-benzodioxol-5-yl)-6-(2-methoxyphenyl)sulfanylimidazo[1,2-b]pyridazine
CID 10762137
N-(2-methoxyphenyl)-2-[2-(4-methoxyphenyl)imidazo[1,2-b]pyridazin-6-yl]sulfanylacetamide
CID 22581668
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-phenylimidazo[1,2-b]pyridazin-6-yl)sulfanylacetamide
CID 18573837
2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol
CID 117130737
2-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid
CID 82371025
N-[3-(6-methoxyimidazo[1,2-b]pyridazin-2-yl)phenyl]-2-phenoxyacetamide
CID 16885820
1-[6-(3-methoxyphenyl)imidazo[1,2-b]pyridazin-2-yl]-3-methylurea
CID 58243153

Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine?
The IUPAC name of 6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine (CID 10568650) is 6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine?
The canonical SMILES for 6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine is COc1cccc(Sc2ccc3nc(-c4ccccc4)cn3n2)c1.
What is the InChIKey of 6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine?
The InChIKey is DYYNIOFIHVVBSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3OS/c1-23-15-8-5-9-16(12-15)24-19-11-10-18-20-17(13-22(18)21-19)14-6-3-2-4-7-14/h2-13H,1H3.
What are the key properties of 6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine?
6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine has a molecular weight of 333.42 g/mol, XLogP of 4.56, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxyphenyl)sulfanyl-2-phenylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 10568650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).