N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide

C24H19N5O2S — CID 24753241

IUPACN-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide
SMILESCc1ccc(-c2nc3ccc(Sc4ccccc4)nn3c2CNC(=O)c2ccno2)cc1
InChIInChI=1S/C24H19N5O2S/c1-16-7-9-17(10-8-16)23-19(15-25-24(30)20-13-14-26-31-20)29-21(27-23)11-12-22(28-29)32-18-5-3-2-4-6-18/h2-14H,15H2,1H3,(H,25,30)
InChIKeyXWYWPCFYHSBLGM-UHFFFAOYSA-N
MW441.52 g/mol
LogP4.77
Rot. Bonds6

About N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide

N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide (PubChem CID 24753241) has the molecular formula C24H19N5O2S and a molecular weight of 441.52 g/mol. Its IUPAC name is N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide
PubChem CID24753241
Molecular FormulaC24H19N5O2S
Molecular Weight441.52 g/mol
Exact Mass441.13
IUPAC NameN-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide
SMILESCc1ccc(-c2nc3ccc(Sc4ccccc4)nn3c2CNC(=O)c2ccno2)cc1
InChIInChI=1S/C24H19N5O2S/c1-16-7-9-17(10-8-16)23-19(15-25-24(30)20-13-14-26-31-20)29-21(27-23)11-12-22(28-29)32-18-5-3-2-4-6-18/h2-14H,15H2,1H3,(H,25,30)
InChIKeyXWYWPCFYHSBLGM-UHFFFAOYSA-N
XLogP4.77
TPSA85.32 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.52
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide 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

N-[(2-naphthalen-2-yl-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl)methyl]benzamide
CID 10552957
N-[[2-(3,4-dimethylphenyl)-6-propylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]benzamide
CID 10320493
N-[[6-bromo-2-(4-tert-butylphenyl)imidazo[1,2-b]pyridazin-3-yl]methyl]benzamide
CID 59445308
N-[[6-chloro-2-(4-methylphenyl)imidazo[1,2-b]pyridazin-3-yl]methyl]pyridine-4-carboxamide
CID 24753236
N-[[2-(1,3-benzodioxol-5-yl)-6-methylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-2-fluorobenzamide
CID 10026023
N-[(6-methyl-2-phenylimidazo[1,2-b]pyridazin-3-yl)methyl]acetamide
CID 10707880
N-[[2-(4-tert-butylphenyl)-6-chloroimidazo[1,2-b]pyridazin-3-yl]methyl]-2-fluorobenzamide
CID 11743772
4-methyl-N-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]benzamide
CID 54857010
N-benzyl-2-[[3-(4-methylphenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetamide
CID 7118156
(4-methoxyphenyl) N-[[6-chloro-2-(4-methylphenyl)imidazo[1,2-b]pyridazin-3-yl]methyl]carbamate
CID 24754065
2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazine
CID 15750003
N-[(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazin-3-yl)methyl]acetamide
CID 24753418

Frequently Asked Questions

What is the IUPAC name of N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide?
The IUPAC name of N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide (CID 24753241) is N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide is Cc1ccc(-c2nc3ccc(Sc4ccccc4)nn3c2CNC(=O)c2ccno2)cc1.
What is the InChIKey of N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide?
The InChIKey is XWYWPCFYHSBLGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N5O2S/c1-16-7-9-17(10-8-16)23-19(15-25-24(30)20-13-14-26-31-20)29-21(27-23)11-12-22(28-29)32-18-5-3-2-4-6-18/h2-14H,15H2,1H3,(H,25,30).
What are the key properties of N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide?
N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide has a molecular weight of 441.52 g/mol, XLogP of 4.77, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(4-methylphenyl)-6-phenylsulfanylimidazo[1,2-b]pyridazin-3-yl]methyl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 24753241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).