5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole

C20H17N3O3 — CID 56897341

IUPAC5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole
SMILESCOc1cccc(-c2nccn2-c2cccc(-c3cnco3)c2)c1OC
InChIInChI=1S/C20H17N3O3/c1-24-17-8-4-7-16(19(17)25-2)20-22-9-10-23(20)15-6-3-5-14(11-15)18-12-21-13-26-18/h3-13H,1-2H3
InChIKeyYZRJNTHPQWOJEP-UHFFFAOYSA-N
MW347.37 g/mol
LogP4.21
Rot. Bonds5

About 5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole

5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole (PubChem CID 56897341) has the molecular formula C20H17N3O3 and a molecular weight of 347.37 g/mol. Its IUPAC name is 5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole.

Molecular Properties

Compound Name5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole
PubChem CID56897341
Molecular FormulaC20H17N3O3
Molecular Weight347.37 g/mol
Exact Mass347.13
IUPAC Name5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole
SMILESCOc1cccc(-c2nccn2-c2cccc(-c3cnco3)c2)c1OC
InChIInChI=1S/C20H17N3O3/c1-24-17-8-4-7-16(19(17)25-2)20-22-9-10-23(20)15-6-3-5-14(11-15)18-12-21-13-26-18/h3-13H,1-2H3
InChIKeyYZRJNTHPQWOJEP-UHFFFAOYSA-N
XLogP4.21
TPSA62.31 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.37
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-[3-[2-(1-piperidin-4-yltriazol-4-yl)imidazol-1-yl]phenyl]-1,3-oxazole;hydrochloride
CID 154898642
2-(2-methoxyphenyl)-1-(4-methylphenyl)imidazole
CID 141122425
3-(2,3-dimethoxyphenyl)pyridine
CID 22001178
6-[3-(1,3-oxazol-5-yl)phenyl]-7H-pyrrolo[3,4-b]pyridin-5-one
CID 50949708
1-(3-methoxy-4-propan-2-ylphenyl)-2-phenylimidazole
CID 156877703
3,12-bis(2,3-dimethoxyphenyl)-1,2,4,5,7,8,10,11-octazatricyclo[7.3.0.02,6]dodeca-3,5,7,9,11-pentaene
CID 156905120
5-[3-[(1S,5R)-3-azabicyclo[3.1.0]hexan-3-yl]phenyl]-1,3-oxazole
CID 142422543
2-(2-methoxyphenyl)-1-[4-(1H-pyrazol-5-yl)phenyl]imidazole
CID 56873972
2-[3-methoxy-2-[(3-methylphenyl)methoxy]phenyl]-1-methylimidazole
CID 110538203
methyl 2-methoxy-5-(1,3-oxazol-5-yl)benzoate
CID 118720203
1-[1-[3-(2,3-dimethoxyphenyl)phenyl]benzimidazol-5-yl]ethanol
CID 24768673
(1R)-1-[1-[3-(2,3-dimethoxyphenyl)phenyl]benzimidazol-5-yl]ethanamine
CID 67096152

Frequently Asked Questions

What is the IUPAC name of 5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole?
The IUPAC name of 5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole (CID 56897341) is 5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole.
What is the SMILES notation for 5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole?
The canonical SMILES for 5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole is COc1cccc(-c2nccn2-c2cccc(-c3cnco3)c2)c1OC.
What is the InChIKey of 5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole?
The InChIKey is YZRJNTHPQWOJEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O3/c1-24-17-8-4-7-16(19(17)25-2)20-22-9-10-23(20)15-6-3-5-14(11-15)18-12-21-13-26-18/h3-13H,1-2H3.
What are the key properties of 5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole?
5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole has a molecular weight of 347.37 g/mol, XLogP of 4.21, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[2-(2,3-dimethoxyphenyl)imidazol-1-yl]phenyl]-1,3-oxazole is sourced from PubChem (CID 56897341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).