formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine

C23H23N5O4 — CID 171708489

IUPACformic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine
SMILESCOc1ccc(-c2cc(-c3nccn3CCc3ccccn3)ccc2OC)nn1.O=CO
InChIInChI=1S/C22H21N5O2.CH2O2/c1-28-20-8-6-16(15-18(20)19-7-9-21(29-2)26-25-19)22-24-12-14-27(22)13-10-17-5-3-4-11-23-17;2-1-3/h3-9,11-12,14-15H,10,13H2,1-2H3;1H,(H,2,3)
InChIKeyYWOSSILTTZWJQX-UHFFFAOYSA-N
MW433.47 g/mol
LogP3.36
Rot. Bonds7

About formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine

formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine (PubChem CID 171708489) has the molecular formula C23H23N5O4 and a molecular weight of 433.47 g/mol. Its IUPAC name is formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine.

Molecular Properties

Compound Nameformic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine
PubChem CID171708489
Molecular FormulaC23H23N5O4
Molecular Weight433.47 g/mol
Exact Mass433.18
IUPAC Nameformic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine
SMILESCOc1ccc(-c2cc(-c3nccn3CCc3ccccn3)ccc2OC)nn1.O=CO
InChIInChI=1S/C22H21N5O2.CH2O2/c1-28-20-8-6-16(15-18(20)19-7-9-21(29-2)26-25-19)22-24-12-14-27(22)13-10-17-5-3-4-11-23-17;2-1-3/h3-9,11-12,14-15H,10,13H2,1-2H3;1H,(H,2,3)
InChIKeyYWOSSILTTZWJQX-UHFFFAOYSA-N
XLogP3.36
TPSA112.25 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.47
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine 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

formic acid;2-[[3-[1-[2-(1-methylpyrazol-4-yl)ethyl]imidazol-2-yl]phenoxy]methyl]pyridine
CID 155940294
N,N-dimethyl-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]pyrimidin-2-amine
CID 56870823
6-[2-methoxy-5-[1-(3-methoxypropyl)imidazol-2-yl]phenyl]pyrimidin-4-amine
CID 165428045
1-(2-pyridin-2-ylethyl)imidazole-2-carbaldehyde
CID 62221205
formic acid;2-[2-methoxy-5-[1-[(4-methylmorpholin-2-yl)methyl]imidazol-2-yl]phenyl]-5-methylpyrimidin-4-amine
CID 166598207
N-[3-(1-propylimidazol-2-yl)phenyl]-3-pyridin-2-ylpropanamide
CID 75427147
formic acid;2-(2-phenylimidazol-1-yl)-N-[(4-phenylphenyl)methyl]ethanamine
CID 70682957
methyl 2-[4-[1-[2-(6-oxo-1H-pyrimidin-4-yl)ethyl]imidazol-2-yl]phenyl]benzoate
CID 165417178
2-(2,3-dimethoxyphenyl)-1-[2-(1-methylpyrazol-4-yl)ethyl]imidazole;formic acid
CID 154924176
3-[[2-(2,3-dimethoxy-5-methylphenyl)imidazol-1-yl]methyl]pyridin-2-amine;formic acid
CID 171712172
3-methoxy-6-[4-[1-[4-(pyridin-2-ylmethoxy)phenyl]cyclobutyl]phenyl]pyridazine
CID 66864843
1-(4-methoxy-2,5-dimethylphenyl)-3-pyridin-2-ylpropan-1-ol
CID 105124333

Frequently Asked Questions

What is the IUPAC name of formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine?
The IUPAC name of formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine (CID 171708489) is formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine.
What is the SMILES notation for formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine?
The canonical SMILES for formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine is COc1ccc(-c2cc(-c3nccn3CCc3ccccn3)ccc2OC)nn1.O=CO.
What is the InChIKey of formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine?
The InChIKey is YWOSSILTTZWJQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N5O2.CH2O2/c1-28-20-8-6-16(15-18(20)19-7-9-21(29-2)26-25-19)22-24-12-14-27(22)13-10-17-5-3-4-11-23-17;2-1-3/h3-9,11-12,14-15H,10,13H2,1-2H3;1H,(H,2,3).
What are the key properties of formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine?
formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine has a molecular weight of 433.47 g/mol, XLogP of 3.36, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for formic acid;3-methoxy-6-[2-methoxy-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]phenyl]pyridazine is sourced from PubChem (CID 171708489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).