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SC-68376

HCID 5174
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
318480-82-9
Standard SMILES
Cc1nc(-c2ccccc2)c(-c2ccncc2)o1
InChIKey
BHWCZLOXTLWZAQ-UHFFFAOYSA-N
Molecular formula
C15H12N2O
Average molar mass
236.27 g/mol
Monoisotopic mass
236.09496301

Overview

2-methyl-4-phenyl-5-pyridin-4-yloxazole is a member of 1,3-oxazoles.

Names & identifiers

Preferred name
SC-68376
IUPAC
2-methyl-4-phenyl-5-pyridin-4-yl-1,3-oxazole
English name
SC-68376
Molecular formula
C15H12N2O
Molecular weight
236.27

Names & synonyms

SC-68376318480-82-94-(2-methyl-4-phenyl-1,3-oxazol-5-yl)pyridineDTXSID10274457RefChem:181640DTXCID80225936sc 683762-Methyl-4-phenyl-5-(4-pyridyl)oxazoleSC68376CHEMBL364502-methyl-4-phenyl-5-(pyridin-4-yl)oxazoleIN1102
Show more names
Pyridine, 4-(2-methyl-4-phenyl-5-oxazolyl)-
2-methyl-4-phenyl-5-pyridin-4-yl-1,3-oxazoleGTPL6039orb1699372SCHEMBL1387446CHEBI:93498BHWCZLOXTLWZAQ-UHFFFAOYSA-NGLXC-01776HMS3229O10

Database identifiers

CAS
318480-82-9
PubChem CID
5174
DTXSID
DTXSID10274457
ChEMBL
CHEMBL36450
ChEBI
CHEBI:93498
Nikkaji
J832.895A

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
38.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
259

Physicochemical properties

Boiling point
352.3 · 352.3±27.0 °C(Predicted)
Density
1.149 · 1.149±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
solubility
18 mg/mL · DMSO: 18 mg/mL
form
solid
pka
3.19 · 3.19±0.10(Predicted)
color
off-white
WGK Germany
3 · 3

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

wgk
3

Chemistry & industry

Applications

UsesSC-68376 is a potent, reversible, ATP-competitive, and selective inhibitor of p38 MAP kinase inhibitor[1][2][3].

Suppliers6 total

Aladdin Scientific[email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
南通全益生物科技有限公司+86-0513; 18051384581 · [email protected]
上海凯裕医药科技有限公司17317130613 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]
济南九黎生物科技有限公司15865264761 · [email protected]

Additional notes

DefinitionChEBI: 2-methyl-4-phenyl-5-pyridin-4-yloxazole is a member of 1,3-oxazoles.

Related reactions

1 records
New reaction record
HRID 1595199 reaction equation
HRID 1595199As productuspto-grants-2001_09

Compound notes

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