4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole

C22H19FN2O3 — CID 91605781

IUPAC4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole
SMILESCOc1cncc(-c2cccc(C3(c4ccc(OC)c(F)c4)COC=N3)c2)c1
InChIInChI=1S/C22H19FN2O3/c1-26-19-9-16(11-24-12-19)15-4-3-5-17(8-15)22(13-28-14-25-22)18-6-7-21(27-2)20(23)10-18/h3-12,14H,13H2,1-2H3
InChIKeyRGQWIRWPSGFDCA-UHFFFAOYSA-N
MW378.40 g/mol
LogP4.21
Rot. Bonds5

About 4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole

4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole (PubChem CID 91605781) has the molecular formula C22H19FN2O3 and a molecular weight of 378.40 g/mol. Its IUPAC name is 4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole.

Molecular Properties

Compound Name4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole
PubChem CID91605781
Molecular FormulaC22H19FN2O3
Molecular Weight378.40 g/mol
Exact Mass378.14
IUPAC Name4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole
SMILESCOc1cncc(-c2cccc(C3(c4ccc(OC)c(F)c4)COC=N3)c2)c1
InChIInChI=1S/C22H19FN2O3/c1-26-19-9-16(11-24-12-19)15-4-3-5-17(8-15)22(13-28-14-25-22)18-6-7-21(27-2)20(23)10-18/h3-12,14H,13H2,1-2H3
InChIKeyRGQWIRWPSGFDCA-UHFFFAOYSA-N
XLogP4.21
TPSA52.94 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.40
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole 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

4-(3-chloro-4-methoxyphenyl)-4-[4-fluoro-3-(5-fluoro-3-pyridinyl)phenyl]-5H-1,3-oxazole
CID 150379653
4-(3-fluoro-4-methoxyphenyl)-4-(3-pyridin-3-ylphenyl)-5H-1,3-oxazol-2-amine;formic acid
CID 67349260
[[4-(4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazol-2-yl]amino] formate
CID 87365849
5-[3-(5-methoxy-3-pyridinyl)phenyl]-5-(trifluoromethyl)-2,6-dihydro-1,4-oxazin-3-amine
CID 54761220
5-[3-(5-methoxy-3-pyridinyl)phenyl]-5-(trifluoromethyl)morpholine-3-thione
CID 89497496
(4S)-4-(3-chloro-4-methoxyphenyl)-4-[4-fluoro-3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazol-2-amine
CID 67345997
4-[3-(5-methoxy-3-pyridinyl)phenyl]-2,4-dimethyl-7H-pyrazolo[1,5-a]pyrazin-6-amine
CID 66828840
3-fluoro-5-[3-[2-(4-methoxy-3-methylphenyl)-4-methylimidazol-2-yl]phenyl]pyridine
CID 66847901
3,3-difluoro-8-(4-methoxyphenyl)-8-[3-(5-methoxy-3-pyridinyl)phenyl]-2,4-dihydroimidazo[1,5-a]pyrimidin-6-amine
CID 24873271
4-[3-(5-methoxy-3-pyridinyl)phenyl]-4-methyl-2-(trifluoromethyl)-7H-pyrazolo[1,5-a]pyrazin-6-amine
CID 56948645
[4-(4-methoxyphenyl)-4-(3-pyrimidin-5-ylphenyl)-5H-1,3-oxazol-2-yl]carbamic acid
CID 91239148
methyl 2-fluoro-4-(5-methoxy-3-pyridinyl)benzoate
CID 70699864

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole?
The IUPAC name of 4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole (CID 91605781) is 4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole.
What is the SMILES notation for 4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole?
The canonical SMILES for 4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole is COc1cncc(-c2cccc(C3(c4ccc(OC)c(F)c4)COC=N3)c2)c1.
What is the InChIKey of 4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole?
The InChIKey is RGQWIRWPSGFDCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN2O3/c1-26-19-9-16(11-24-12-19)15-4-3-5-17(8-15)22(13-28-14-25-22)18-6-7-21(27-2)20(23)10-18/h3-12,14H,13H2,1-2H3.
What are the key properties of 4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole?
4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole has a molecular weight of 378.40 g/mol, XLogP of 4.21, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluoro-4-methoxyphenyl)-4-[3-(5-methoxy-3-pyridinyl)phenyl]-5H-1,3-oxazole is sourced from PubChem (CID 91605781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).